N-Cyclopentyl L-Z-Isoleucinamide - CAS 1423037-32-4
Catalog: |
BB069089 |
Product Name: |
N-Cyclopentyl L-Z-Isoleucinamide |
CAS: |
1423037-32-4 |
Synonyms: |
N-Cyclopentyl L-Z-isoleucinamide; benzyl N-[(2S,3S)-1-(cyclopentylamino)-3-methyl-1-oxopentan-2-yl]carbamate; Carbamic acid, N-[(1R,2R)-1-[(cyclopentylamino)carbonyl]-2-methylbutyl]-, phenylmethyl ester, rel- |
IUPAC Name: | benzyl N-[(2S,3S)-1-(cyclopentylamino)-3-methyl-1-oxopentan-2-yl]carbamate |
Description: | N-Cyclopentyl L-Z-Isoleucinamide |
Molecular Weight: | 332.44 |
Molecular Formula: | C19H28N2O3 |
Canonical SMILES: | CCC(C)C(C(=O)NC1CCCC1)NC(=O)OCC2=CC=CC=C2 |
InChI: | InChI=1S/C19H28N2O3/c1-3-14(2)17(18(22)20-16-11-7-8-12-16)21-19(23)24-13-15-9-5-4-6-10-15/h4-6,9-10,14,16-17H,3,7-8,11-13H2,1-2H3,(H,20,22)(H,21,23)/t14-,17-/m0/s1 |
InChI Key: | ZMFUFWBELOGFHE-YOEHRIQHSA-N |
Complexity: | 401 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 332.20999276 |
Formal Charge: | 0 |
Heavy Atom Count: | 24 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 332.20999276 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 67.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.8 |
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