ethyl 4-({cyclohexyl[(4-fluorophenyl)methyl]carbamothioyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({cyclohexyl[(4-fluorophenyl)methyl]carbamothioyl}amino)benzoate
ethyl 4-({cyclohexyl[(4-fluorophenyl)methyl]carbamothioyl}amino)benzoate
Compound characteristics
| Compound ID: | K784-4427 |
| Compound Name: | ethyl 4-({cyclohexyl[(4-fluorophenyl)methyl]carbamothioyl}amino)benzoate |
| Molecular Weight: | 414.54 |
| Molecular Formula: | C23 H27 F N2 O2 S |
| Smiles: | CCOC(c1ccc(cc1)NC(N(Cc1ccc(cc1)F)C1CCCCC1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1576 |
| logD: | 6.1576 |
| logSw: | -5.3875 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.4262 |
| InChI Key: | OTAMZAPTSCFJEH-UHFFFAOYSA-N |