4-chloro-N-{[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
Chemical Structure Depiction of
4-chloro-N-{[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
4-chloro-N-{[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
Compound characteristics
| Compound ID: | 3616-2285 |
| Compound Name: | 4-chloro-N-{[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide |
| Molecular Weight: | 421.9 |
| Molecular Formula: | C22 H16 Cl N3 O2 S |
| Smiles: | Cc1cccc(c1)c1nc2cc(ccc2o1)NC(NC(c1ccc(cc1)[Cl])=O)=S |
| Stereo: | ACHIRAL |
| logP: | 5.8143 |
| logD: | 5.8079 |
| logSw: | -6.0869 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.05 |
| InChI Key: | VAEMOUYZENRPCT-UHFFFAOYSA-N |