4-chloro-N-({5-methyl-4-[4-(propan-2-yl)phenyl]-1,3-thiazol-2-yl}carbamothioyl)benzamide
Chemical Structure Depiction of
4-chloro-N-({5-methyl-4-[4-(propan-2-yl)phenyl]-1,3-thiazol-2-yl}carbamothioyl)benzamide
4-chloro-N-({5-methyl-4-[4-(propan-2-yl)phenyl]-1,3-thiazol-2-yl}carbamothioyl)benzamide
Compound characteristics
| Compound ID: | Y501-6018 |
| Compound Name: | 4-chloro-N-({5-methyl-4-[4-(propan-2-yl)phenyl]-1,3-thiazol-2-yl}carbamothioyl)benzamide |
| Molecular Weight: | 429.99 |
| Molecular Formula: | C21 H20 Cl N3 O S2 |
| Smiles: | CC(C)c1ccc(cc1)c1c(C)sc(NC(NC(c2ccc(cc2)[Cl])=O)=S)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.8394 |
| logD: | 6.8393 |
| logSw: | -6.6136 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.785 |
| InChI Key: | FGRSBVCFGGGIRE-UHFFFAOYSA-N |