N-[(4-methyl-2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[(4-methyl-2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide
N-[(4-methyl-2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | 3820-2338 |
| Compound Name: | N-[(4-methyl-2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide |
| Molecular Weight: | 321.37 |
| Molecular Formula: | C13 H11 N3 O3 S2 |
| Smiles: | Cc1ccc(c(c1)[N+]([O-])=O)NC(NC(c1cccs1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 3.8455 |
| logD: | 3.8315 |
| logSw: | -3.9956 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.641 |
| InChI Key: | CKFMBRVMVDSLCR-UHFFFAOYSA-N |