N-{[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]carbamothioyl}-2-(4-chlorophenyl)acetamide
Chemical Structure Depiction of
N-{[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]carbamothioyl}-2-(4-chlorophenyl)acetamide
N-{[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]carbamothioyl}-2-(4-chlorophenyl)acetamide
Compound characteristics
| Compound ID: | 4799-3338 |
| Compound Name: | N-{[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]carbamothioyl}-2-(4-chlorophenyl)acetamide |
| Molecular Weight: | 451.93 |
| Molecular Formula: | C23 H18 Cl N3 O3 S |
| Smiles: | COc1ccc(cc1NC(NC(Cc1ccc(cc1)[Cl])=O)=S)c1nc2ccccc2o1 |
| Stereo: | ACHIRAL |
| logP: | 5.145 |
| logD: | 5.145 |
| logSw: | -5.676 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.769 |
| InChI Key: | CADHVDCAQSYZKR-UHFFFAOYSA-N |