N-{[4-(dimethylamino)phenyl]methyl}-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-(4-nitrophenoxy)acetamide
Chemical Structure Depiction of
N-{[4-(dimethylamino)phenyl]methyl}-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-(4-nitrophenoxy)acetamide
N-{[4-(dimethylamino)phenyl]methyl}-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-(4-nitrophenoxy)acetamide
Compound characteristics
Compound ID: | 6214-0675 |
Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-(4-nitrophenoxy)acetamide |
Molecular Weight: | 447.51 |
Molecular Formula: | C21 H25 N3 O6 S |
Smiles: | CN(C)c1ccc(CN(C2CCS(C2)(=O)=O)C(COc2ccc(cc2)[N+]([O-])=O)=O)cc1 |
Stereo: | RACEMIC MIXTURE |
logP: | 1.7702 |
logD: | 1.7548 |
logSw: | -2.5435 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 87.018 |
InChI Key: | FJGCQGRRYVDQJI-LJQANCHMSA-N |