4-({[(4-chlorophenyl)methyl][(4-methoxyphenyl)carbamothioyl]amino}methyl)cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
4-({[(4-chlorophenyl)methyl][(4-methoxyphenyl)carbamothioyl]amino}methyl)cyclohexane-1-carboxylic acid
4-({[(4-chlorophenyl)methyl][(4-methoxyphenyl)carbamothioyl]amino}methyl)cyclohexane-1-carboxylic acid
Compound characteristics
Compound ID: | K784-4869 |
Compound Name: | 4-({[(4-chlorophenyl)methyl][(4-methoxyphenyl)carbamothioyl]amino}methyl)cyclohexane-1-carboxylic acid |
Molecular Weight: | 447 |
Molecular Formula: | C23 H27 Cl N2 O3 S |
Smiles: | COc1ccc(cc1)NC(N(CC1CCC(CC1)C(O)=O)Cc1ccc(cc1)[Cl])=S |
Stereo: | ACHIRAL |
logP: | 5.1111 |
logD: | 2.5508 |
logSw: | -5.219 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 46.572 |
InChI Key: | FQTNDGGQFZPGRN-UHFFFAOYSA-N |