N-{[4-(dimethylamino)phenyl]methyl}-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-4-nitrobenzamide
Chemical Structure Depiction of
N-{[4-(dimethylamino)phenyl]methyl}-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-4-nitrobenzamide
N-{[4-(dimethylamino)phenyl]methyl}-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | 6214-0662 |
| Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-4-nitrobenzamide |
| Molecular Weight: | 417.48 |
| Molecular Formula: | C20 H23 N3 O5 S |
| Smiles: | CN(C)c1ccc(CN(C2CCS(C2)(=O)=O)C(c2ccc(cc2)[N+]([O-])=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9745 |
| logD: | 1.9591 |
| logSw: | -2.6217 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.046 |
| InChI Key: | NLZVLHRYJVBLMD-LJQANCHMSA-N |