N-benzyl-N~2~-(4-chlorobenzene-1-sulfonyl)-N~2~-(3-methylbutyl)-N-[(6-methyl-4-oxo-4H-1-benzopyran-3-yl)methyl]glycinamide
Chemical Structure Depiction of
N-benzyl-N~2~-(4-chlorobenzene-1-sulfonyl)-N~2~-(3-methylbutyl)-N-[(6-methyl-4-oxo-4H-1-benzopyran-3-yl)methyl]glycinamide
N-benzyl-N~2~-(4-chlorobenzene-1-sulfonyl)-N~2~-(3-methylbutyl)-N-[(6-methyl-4-oxo-4H-1-benzopyran-3-yl)methyl]glycinamide
Compound characteristics
| Compound ID: | V008-9956 |
| Compound Name: | N-benzyl-N~2~-(4-chlorobenzene-1-sulfonyl)-N~2~-(3-methylbutyl)-N-[(6-methyl-4-oxo-4H-1-benzopyran-3-yl)methyl]glycinamide |
| Molecular Weight: | 581.13 |
| Molecular Formula: | C31 H33 Cl N2 O5 S |
| Smiles: | CC(C)CCN(CC(N(CC1=COc2ccc(C)cc2C1=O)Cc1ccccc1)=O)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0623 |
| logD: | 6.0623 |
| logSw: | -6.0067 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 68.169 |
| InChI Key: | VXTZMBMPHHSEQO-UHFFFAOYSA-N |