3-{[rel-(1R,2R)-2-hydroxycyclohexyl]amino}benzoic acid
Chemical Structure Depiction of
3-{[rel-(1R,2R)-2-hydroxycyclohexyl]amino}benzoic acid
3-{[rel-(1R,2R)-2-hydroxycyclohexyl]amino}benzoic acid
Compound characteristics
| Compound ID: | 8010-4009 |
| Compound Name: | 3-{[rel-(1R,2R)-2-hydroxycyclohexyl]amino}benzoic acid |
| Molecular Weight: | 235.28 |
| Molecular Formula: | C13 H17 N O3 |
| Smiles: | C1CC[C@@H]([C@H](C1)Nc1cccc(c1)C(O)=O)O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.5275 |
| logD: | -0.354 |
| logSw: | -2.6573 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 54.612 |
| InChI Key: | XWVIRYULESBCNC-RYUDHWBXSA-N |