3-{4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl}-1-cyclohexylurea



Compound number:
MolPort-006-328-766
CAS number: 57460-41-0
IUPAC:
3-{4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl}-1-cyclohexylurea
IUPAC traditional:
talinolol
SMILES:
CC(C)(C)NCC(O)COc1ccc(NC(=O)NC2CCCCC2)cc1
InChI key:
MXFWWQICDIZSOA-UHFFFAOYSA-N
Molecular formula:
C20H33N3O3
Molecular weight: 363.502
Solubility: not available

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Supplier Catalogue Data


Catalog: Screening compound Ships out: 15 business days Purity: 90+% BY 1H NMR
Last updated: 3 months ago In warehouse: Unverified Salt: free
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1 mg October 13, 2020 15.00 USD
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5 mg October 13, 2020 25.00 USD
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10 mg October 13, 2020 30.00 USD
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Catalog: Screening compound Ships out: 5 business days Purity: n/a
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1 micromol September 29, 2020 60.00 USD
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2 micromol September 29, 2020 79.20 USD
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5 micromol September 29, 2020 124.00 USD
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Catalog: Screening compound Ships out: 20 business days Purity: >=95%
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1 mg October 20, 2020 53.24 USD
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5 mg October 20, 2020 226.27 USD
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10 mg October 20, 2020 423.50 USD
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Catalog: Building blocks Ships out: 20 business days Purity: 95%
Last updated: > 3 months ago In warehouse: Unverified
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5 g October 20, 2020 2500.00 USD
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More Information

Compound Identifiers
Compound number: MolPort-006-328-766
CAS number: 57460-41-0

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000000538582
ZINC000001846283
MFCD00864592
1-(4-(3-(tert-Butylamino)-2-hydroxypropoxy)phenyl) -3-cyclohexylurea
1-(4-(3-(tert-Butylamino)-2-hydroxypropoxy)phenyl)-3-cyclohexylurea
1-{4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl}-3-cyclohexylurea
N-(4-{3-[(tert-butyl)amino]-2-hydroxypropoxy}phenyl)(cyclohexylamino)carboxami de
N-cyclohexyl-N'-[4-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]phenyl]-urea
rac Talinolol
rac-Talinolol
(?)-Talinolol

InChI
InChI: 1S/C20H33N3O3/c1-20(2,3)21-13-17(24)14-26-18-11-9-16(10-12-18)23-19(25)22-15-7-5-4-6-8-15/h9-12,15,17,21,24H,4-8,13-14H2,1-3H3,(H2,22,23,25)
InChI key: MXFWWQICDIZSOA-UHFFFAOYSA-N

Calculated Properties
Molecular formula: C20H33N3O3
Molecular weight: 363.502

Scaffolds

Other

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2020 MolPort, v3.91, release date 21-09-2020 17:00 (+0200). All rights reserved.
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