4-[(2-methylcyclohexyl)amino]-3-nitrobenzoic acid
Chemical Structure Depiction of
4-[(2-methylcyclohexyl)amino]-3-nitrobenzoic acid
4-[(2-methylcyclohexyl)amino]-3-nitrobenzoic acid
Compound characteristics
| Compound ID: | K781-0035 |
| Compound Name: | 4-[(2-methylcyclohexyl)amino]-3-nitrobenzoic acid |
| Molecular Weight: | 278.31 |
| Molecular Formula: | C14 H18 N2 O4 |
| Smiles: | CC1CCCCC1Nc1ccc(cc1[N+]([O-])=O)C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0337 |
| logD: | 1.214 |
| logSw: | -4.1312 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.379 |
| InChI Key: | JZOBUCVZJDQOFJ-UHFFFAOYSA-N |