N-[(4-tert-butyl-2-nitrophenyl)carbamothioyl]benzamide
Chemical Structure Depiction of
N-[(4-tert-butyl-2-nitrophenyl)carbamothioyl]benzamide
N-[(4-tert-butyl-2-nitrophenyl)carbamothioyl]benzamide
Compound characteristics
| Compound ID: | 8002-7325 |
| Compound Name: | N-[(4-tert-butyl-2-nitrophenyl)carbamothioyl]benzamide |
| Molecular Weight: | 357.43 |
| Molecular Formula: | C18 H19 N3 O3 S |
| Smiles: | CC(C)(C)c1ccc(c(c1)[N+]([O-])=O)NC(NC(c1ccccc1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 4.9715 |
| logD: | 4.9622 |
| logSw: | -4.7062 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.622 |
| InChI Key: | ZOOFKBCQNKKVJB-UHFFFAOYSA-N |