4-chloro-N-{[2-methyl-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide
Chemical Structure Depiction of
4-chloro-N-{[2-methyl-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide
4-chloro-N-{[2-methyl-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide
Compound characteristics
| Compound ID: | 3616-2616 |
| Compound Name: | 4-chloro-N-{[2-methyl-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide |
| Molecular Weight: | 435.93 |
| Molecular Formula: | C23 H18 Cl N3 O2 S |
| Smiles: | Cc1ccc2c(c1)nc(c1cccc(c1C)NC(NC(c1ccc(cc1)[Cl])=O)=S)o2 |
| Stereo: | ACHIRAL |
| logP: | 6.0888 |
| logD: | 6.0737 |
| logSw: | -6.0802 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.352 |
| InChI Key: | HLQHCZMFBFIJHL-UHFFFAOYSA-N |