AC1LX69Z
(3-benzyl-4,8-dimethyl-2-oxochromen-7-yl) (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate
Also Known As: (S)-3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl 3-methyl-2-(4-methylphenylsulfonamido)butanoate|3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-valinate|(3-benzyl-4,8-dimethyl-2-oxochromen-7-yl) (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate|3-BENZYL-4,8-DIMETHYL-2-OXO-2H-CHROMEN-7-YL 3-METHYL-2-(4-METHYLBENZENESULFONAMIDO)BUTANOATE
| Molecular Formula | C30H31NO6S |
|---|---|
| Molecular Weight | 533.1872 g/mol |
| LogP | 5.21756 |
| Topological Polar Surface Area | 102.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 533.1872 |
| Monoisotopic Mass | 533.1872 |
| Heavy Atoms | 38 |
| Complexity | 1638.7233 |
Chemical Identifiers
| CAS Number | 956705-59-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C(C)C)C(=O)OC2=C(C3=C(C=C2)C(=C(C(=O)O3)CC4=CC=CC=C4)C)C |
Product Overview
AC1LX69Z (CAS 956705-59-2), with molecular formula C30H31NO6S and molecular weight 533.1872 g/mol. IUPAC: (3-benzyl-4,8-dimethyl-2-oxochromen-7-yl) (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate.
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