3-(2-chloro-5-nitrophenyl)-3-(3-cyclohexylpropanamido)propanoic acid
Chemical Structure Depiction of
3-(2-chloro-5-nitrophenyl)-3-(3-cyclohexylpropanamido)propanoic acid
3-(2-chloro-5-nitrophenyl)-3-(3-cyclohexylpropanamido)propanoic acid
Compound characteristics
| Compound ID: | 8015-6811 |
| Compound Name: | 3-(2-chloro-5-nitrophenyl)-3-(3-cyclohexylpropanamido)propanoic acid |
| Molecular Weight: | 382.84 |
| Molecular Formula: | C18 H23 Cl N2 O5 |
| Smiles: | C1CCC(CC1)CCC(NC(CC(O)=O)c1cc(ccc1[Cl])[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1336 |
| logD: | 1.4959 |
| logSw: | -4.2933 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.026 |
| InChI Key: | VCSIVGWPJHXVMI-INIZCTEOSA-N |