O-{3-[(3-methylphenyl)carbamoyl]phenyl} (4-chlorophenyl)carbamothioate
Chemical Structure Depiction of
O-{3-[(3-methylphenyl)carbamoyl]phenyl} (4-chlorophenyl)carbamothioate
O-{3-[(3-methylphenyl)carbamoyl]phenyl} (4-chlorophenyl)carbamothioate
Compound characteristics
| Compound ID: | 8003-5569 |
| Compound Name: | O-{3-[(3-methylphenyl)carbamoyl]phenyl} (4-chlorophenyl)carbamothioate |
| Molecular Weight: | 396.89 |
| Molecular Formula: | C21 H17 Cl N2 O2 S |
| Smiles: | Cc1cccc(c1)NC(c1cccc(c1)OC(Nc1ccc(cc1)[Cl])=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7526 |
| logD: | 5.7444 |
| logSw: | -6.0728 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.369 |
| InChI Key: | XDQMQVQFCUMNKJ-UHFFFAOYSA-N |