methyl 3-{[(3-chloro-4-methylphenyl)carbamothioyl]amino}-4-[(4-methylphenyl)sulfanyl]benzoate
Chemical Structure Depiction of
methyl 3-{[(3-chloro-4-methylphenyl)carbamothioyl]amino}-4-[(4-methylphenyl)sulfanyl]benzoate
methyl 3-{[(3-chloro-4-methylphenyl)carbamothioyl]amino}-4-[(4-methylphenyl)sulfanyl]benzoate
Compound characteristics
| Compound ID: | K786-1400 |
| Compound Name: | methyl 3-{[(3-chloro-4-methylphenyl)carbamothioyl]amino}-4-[(4-methylphenyl)sulfanyl]benzoate |
| Molecular Weight: | 457.01 |
| Molecular Formula: | C23 H21 Cl N2 O2 S2 |
| Smiles: | Cc1ccc(cc1)Sc1ccc(cc1NC(Nc1ccc(C)c(c1)[Cl])=S)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 8.0807 |
| logD: | 8.0807 |
| logSw: | -6.6922 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.265 |
| InChI Key: | YFTPTZZUBPTYGS-UHFFFAOYSA-N |