1-{3-acetyl-4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl}-3,3-diethylurea hydrochloride

Compound number:
MolPort-005-935-373
CAS number: 57470-78-7
IUPAC:
1-{3-acetyl-4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl}-3,3-diethylurea hydrochloride
IUPAC traditional:
celiprolol hydrochloride
SMILES:
Cl.CCN(CC)C(=O)Nc1ccc(OCC(O)CNC(C)(C)C)c(c1)C(C)=O
InChI key:
VKJHTUVLJYWAEY-UHFFFAOYSA-N
Molecular formula:
C20H34ClN3O4
Molecular weight: 415.96
Solubility: not available

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S&H to USA: 40.00 USD
S&H to World: 60.00 USD

Supplier Catalogue Data


Catalog: Screening compound Ships out: 2 business days Purity: 98.0
Last updated: > 3 months ago In warehouse: Unverified
Pack size Ships out Price Qty
10 mg January 29, 2020 159.30 USD
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50 mg January 29, 2020 442.50 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: last week In warehouse: Unverified
Pack size Ships out Price Qty
1 mg February 24, 2020 51.92 USD
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5 mg February 24, 2020 141.60 USD
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10 mg February 24, 2020 217.12 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: n/a
In warehouse: Made to order
Pack size Ships out Price Qty
1 mg February 24, 2020 102.00 USD
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5 mg February 24, 2020 194.00 USD
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10 mg February 24, 2020 270.00 USD
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More Information

Compound Identifiers
Compound number: MolPort-005-935-373
CAS number: 57470-78-7

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000002001884
ZINC000003813069
MFCD00941500
1-{3-acetyl-4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl}-3,3-diethylurea hydrochloride
3-(3-Acetyl-4-(3-(tert-butylamino)-2-hydroxypropoxy)phenyl)-1,1-diethylurea hydrochloride
3-[3-Acetyl-4-(3-tert-butylamino-2-hydroxy-propoxy)-phenyl]-1,1-diethyl-urea hydrochloride
Celiprolol HCl
Celiprolol (hydrochloride)
Celiprolol Hydrochloride
N'-??[3-??acetyl-??4-??[3-??[(1,?1-??dimethylethyl)?amino]-?2-??hydroxypropoxy]?phenyl]?-??N,?N-?diethyl-?urea, monohydrochloride
Urea, N'-[3-acetyl-4-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]phenyl]-N,N-diethyl-, hydrochloride (1:1)

InChI
InChI: 1S/C20H33N3O4.ClH/c1-7-23(8-2)19(26)22-15-9-10-18(17(11-15)14(3)24)27-13-16(25)12-21-20(4,5)6;/h9-11,16,21,25H,7-8,12-13H2,1-6H3,(H,22,26);1H
InChI key: VKJHTUVLJYWAEY-UHFFFAOYSA-N

Calculated Properties
Molecular formula: C20H34ClN3O4
Molecular weight: 415.96

Other

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