(2E)-3-{3,5-difluoro-4-[(1R,3R)-2-(2-fluoro-2-methylpropyl)-3-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-yl]phenyl}prop-2-enoic acid

Compound number:
MolPort-044-560-384
CAS number: 1639042-08-2
IUPAC:
(2E)-3-{3,5-difluoro-4-[(1R,3R)-2-(2-fluoro-2-methylpropyl)-3-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-yl]phenyl}prop-2-enoic acid
IUPAC traditional:
(2E)-3-{3,5-difluoro-4-[(1R,3R)-2-(2-fluoro-2-methylpropyl)-3-methyl-1H,3H,4H,9H-pyrido[3,4-b]indol-1-yl]phenyl}prop-2-enoic acid
SMILES:
C[C@@H]1Cc2c([nH]c3ccccc23)[C@H](N1CC(C)(C)F)c1c(F)cc(\C=C\C(O)=O)cc1F |r|
InChI key:
DFBDRVGWBHBJNR-BBNFHIFMSA-N
Molecular formula:
C25H25F3N2O2
Molecular weight: 442.482
Solubility: not available

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Price range: from to USD Pack size: from to mg
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S&H to World: 85.00 USD

Supplier Catalogue Data


Catalog: Screening compound Ships out: 7 business days Purity: n/a
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2 mg February 4, 2020 90.86 USD
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5 mg February 4, 2020 141.60 USD
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10 mg February 4, 2020 245.44 USD
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Catalog: Screening compound Ships out: 7 business days Purity: n/a
Last updated: > 3 months ago In warehouse: Unverified Salt: Free Base
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2 mg February 4, 2020 114.00 USD
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5 mg February 4, 2020 196.80 USD
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25 mg February 4, 2020 644.40 USD
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Catalog: Screening compound Ships out: 20 business days Purity: >=98%
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1 mg February 21, 2020 51.92 USD
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5 mg February 21, 2020 233.64 USD
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10 mg February 21, 2020 413.00 USD
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Catalog: Building blocks Ships out: 7 business days Purity: 98+%
Last updated: this month In warehouse: 1.23 g
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1 mg February 4, 2020 28.00 USD
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5 mg February 4, 2020 118.00 USD
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10 mg February 4, 2020 219.00 USD
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Catalog: Building blocks Ships out: 10 business days Purity: 98%
Last updated: this month In warehouse: 1.23 g
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2 mg February 7, 2020 103.00 USD
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5 mg February 7, 2020 171.00 USD
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10 mg February 7, 2020 301.00 USD
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S&H to USA: 80.00 USD
S&H to World: 100.00 USD

Supplier Catalogue Data


Catalog: Building blocks Ships out: 10 business days Purity: 99%
Last updated: > 3 months ago In warehouse: Unverified
Pack size Ships out Price Qty
2 mg February 7, 2020 196.00 USD
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5 mg February 7, 2020 265.00 USD
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10 mg February 7, 2020 403.00 USD
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More Information

Compound Identifiers
Compound number: MolPort-044-560-384
CAS number: 1639042-08-2

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000219669733
MFCD28902195
(2E)-3-[3,5-difluoro-4-[(1R,3R)-2-(2-fluoro-2-methylpropyl)-2,3,4,9-tetrahydro-3-methyl-1H-pyrido[3,4-b]indol-1-yl]phenyl]-2-propenoic acid
2-Propenoic acid, 3-[3,5-difluoro-4-[(1R,3R)-2-(2-fluoro-2-methylpropyl)-2,3,4,9-tetrahydro-3-methyl-1H-pyrido[3,4-b]indol-1-yl]phenyl]-, (2E)-
AZD 9496
AZD9496

InChI
InChI: 1S/C25H25F3N2O2/c1-14-10-17-16-6-4-5-7-20(16)29-23(17)24(30(14)13-25(2,3)28)22-18(26)11-15(12-19(22)27)8-9-21(31)32/h4-9,11-12,14,24,29H,10,13H2,1-3H3,(H,31,32)/b9-8+/t14-,24-/m1/s1
InChI key: DFBDRVGWBHBJNR-BBNFHIFMSA-N

Calculated Properties
Molecular formula: C25H25F3N2O2
Molecular weight: 442.482

Other

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2020 MolPort, v3.33, release date 22-01-2020 14:00 (+0200). All rights reserved.
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