4-({[(2-chlorophenyl)carbamothioyl][(4-chlorophenyl)methyl]amino}methyl)benzoic acid
Chemical Structure Depiction of
4-({[(2-chlorophenyl)carbamothioyl][(4-chlorophenyl)methyl]amino}methyl)benzoic acid
4-({[(2-chlorophenyl)carbamothioyl][(4-chlorophenyl)methyl]amino}methyl)benzoic acid
Compound characteristics
| Compound ID: | K784-4537 |
| Compound Name: | 4-({[(2-chlorophenyl)carbamothioyl][(4-chlorophenyl)methyl]amino}methyl)benzoic acid |
| Molecular Weight: | 445.37 |
| Molecular Formula: | C22 H18 Cl2 N2 O2 S |
| Smiles: | C(c1ccc(cc1)C(O)=O)N(Cc1ccc(cc1)[Cl])C(Nc1ccccc1[Cl])=S |
| Stereo: | ACHIRAL |
| logP: | 5.9406 |
| logD: | 2.9691 |
| logSw: | -5.7279 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 38.138 |
| InChI Key: | MTIRNVYMZNNLND-UHFFFAOYSA-N |