4-[(2S)-2-(N-methylisoquinoline-5-sulfonamido)-3-oxo-3-(4-phenylpiperazin-1-yl)propyl]phenyl isoquinoline-5-sulfonate

Compound number:
MolPort-003-941-788
CAS number: 127191-97-3
IUPAC:
4-[(2S)-2-(N-methylisoquinoline-5-sulfonamido)-3-oxo-3-(4-phenylpiperazin-1-yl)propyl]phenyl isoquinoline-5-sulfonate
IUPAC traditional:
4-[(2S)-2-(N-methylisoquinoline-5-sulfonamido)-3-oxo-3-(4-phenylpiperazin-1-yl)propyl]phenyl isoquinoline-5-sulfonate
SMILES:
CN([C@@H](Cc1ccc(OS(=O)(=O)c2cccc3cnccc23)cc1)C(=O)N1CCN(CC1)c1ccccc1)S(=O)(=O)c1cccc2cnccc12 |r|
InChI key:
RJVLFQBBRSMWHX-DHUJRADRSA-N
Molecular formula:
C38H35N5O6S2
Molecular weight: 721.85

Marketplace Offers

Price range: from to USD Pack size: from to mg
In warehouse: from to mg Lead time: from to days
S&H to USA: 60.00 USD
S&H to World: 60.00 USD

Supplier Catalogue Data


Catalog: Screening compound Ships out: 5 business days Purity: >98%
Last updated: this month In warehouse: Unverified
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1 mg August 30, 2019 175.82 USD
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S&H to USA: 30.00 USD
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Supplier Catalogue Data


Catalog: Screening compound Ships out: 7 business days Purity: 98.77%
Last updated: last month In warehouse: 968.00 mg
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2 mg September 3, 2019 50.00 USD
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5 mg September 3, 2019 70.00 USD
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10 mg September 3, 2019 137.00 USD
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S&H to USA: 50.00 USD
S&H to World: 85.00 USD

Supplier Catalogue Data


Catalog: Screening compound Ships out: 7 business days Purity: n/a
Last updated: > 3 months ago In warehouse: Unverified
Pack size Ships out Price Qty
5 mg September 3, 2019 102.66 USD
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10 mg September 3, 2019 193.52 USD
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50 mg September 3, 2019 876.74 USD
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S&H to USA: 40.00 USD
S&H to World: 100.00 USD

Supplier Catalogue Data


Catalog: Screening compound Ships out: 7 business days Purity: n/a
Last updated: > 3 months ago In warehouse: Unverified Salt: Free Base
Pack size Ships out Price Qty
5 mg September 3, 2019 114.00 USD
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25 mg September 3, 2019 400.80 USD
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S&H to USA: 60.00 USD
S&H to World: 180.00 USD

Supplier Catalogue Data


Catalog: Screening compound Ships out: 20 business days Purity: >=98%
Last updated: > 3 months ago In warehouse: Unverified
Pack size Ships out Price Qty
1 mg September 20, 2019 57.82 USD
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5 mg September 20, 2019 129.80 USD
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10 mg September 20, 2019 230.10 USD
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S&H to USA: 90.00 USD
S&H to World: 95.00 USD

Supplier Catalogue Data


Catalog: Building blocks Ships out: 7 business days Purity: 98+%
Last updated: last month In warehouse: 399.00 mg
Pack size Ships out Price Qty
1 mg September 3, 2019 37.00 USD
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5 mg September 3, 2019 78.00 USD
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10 mg September 3, 2019 148.00 USD
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S&H to USA: 20.00 USD
S&H to World: 120.00 USD

Supplier Catalogue Data


Catalog: Made to order Ships out: 20 business days Purity: 95.00%
In warehouse: Made to order
Pack size Ships out Price Qty
5 mg September 20, 2019 174.00 USD
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10 mg September 20, 2019 281.00 USD
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50 mg September 20, 2019 1097.00 USD
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More Information

Compound Identifiers
Compound number: MolPort-003-941-788
CAS number: 127191-97-3

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000004262461
MFCD00083180
1-(N,O-bis(5-isoquinolinesulfonyl)-N-methyl-L-tyrosyl)-4-phenylpiperazine
4-[(2S)-2-[(5-isoquinolinylsulfonyl)methylamino]-3-oxo- 3-(4-phenyl-1-piperazinyl)propyl]phenylisoquinolinesulfonicacid ester KN-62
4-[(2S)-2-[(5-isoquinolinylsulfonyl)methylamino]-3-oxo-3-(4-phenyl-1-piperazinyl)propyl]phenyl ester, 5-isoquinolinesulfonic acid
[4-[(2S)-2-[5-isoquinolylsulfonyl(methyl)amino]-3-oxo-3-(4-phenylpiperazin-1-yl)propyl]phenyl] isoquinoline-5-sulfonate
5-isoquinolinesulfonic acid [4-[(2S)-2-[5-isoquinolinylsulfonyl(methyl)amino]-3-oxo-3-(4-phenyl-1-piperazinyl)propyl]phenyl] ester [4-[(2S)-2-[isoquinolin-5-ylsulfonyl(methyl)amino]-3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]phenyl] isoquinoline-5-sulfonate
KN-62
(S)-4-(2-(N-Methylisoquinoline-5-sulfonamido)-3-oxo-3-(4-phenylpiperazin-1-yl)propyl)phenyl isoquinoline-5-sulfonate

InChI
InChI: 1S/C38H35N5O6S2/c1-41(50(45,46)36-11-5-7-29-26-39-19-17-33(29)36)35(38(44)43-23-21-42(22-24-43)31-9-3-2-4-10-31)25-28-13-15-32(16-14-28)49-51(47,48)37-12-6-8-30-27-40-20-18-34(30)37/h2-20,26-27,35H,21-25H2,1H3/t35-/m0/s1
InChI key: RJVLFQBBRSMWHX-DHUJRADRSA-N

Calculated Properties
Molecular formula: C38H35N5O6S2
Molecular weight: 721.85

Other

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2019 MolPort, v3.11, release date 23-08-2019 16:00 (+0200). All rights reserved.
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