O-{4-[(4-chlorophenyl)carbamoyl]phenyl} [4-(dimethylamino)phenyl]carbamothioate
Chemical Structure Depiction of
O-{4-[(4-chlorophenyl)carbamoyl]phenyl} [4-(dimethylamino)phenyl]carbamothioate
O-{4-[(4-chlorophenyl)carbamoyl]phenyl} [4-(dimethylamino)phenyl]carbamothioate
Compound characteristics
| Compound ID: | 8001-4347 |
| Compound Name: | O-{4-[(4-chlorophenyl)carbamoyl]phenyl} [4-(dimethylamino)phenyl]carbamothioate |
| Molecular Weight: | 425.94 |
| Molecular Formula: | C22 H20 Cl N3 O2 S |
| Smiles: | CN(C)c1ccc(cc1)NC(Oc1ccc(cc1)C(Nc1ccc(cc1)[Cl])=O)=S |
| Stereo: | ACHIRAL |
| logP: | 5.4881 |
| logD: | 5.4775 |
| logSw: | -6.0761 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.174 |
| InChI Key: | KKGDGPMBXFHDIG-UHFFFAOYSA-N |