6-{[(pyridin-4-yl)methyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Chemical Structure Depiction of
6-{[(pyridin-4-yl)methyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
6-{[(pyridin-4-yl)methyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Compound characteristics
| Compound ID: | Y204-2545 |
| Compound Name: | 6-{[(pyridin-4-yl)methyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid |
| Molecular Weight: | 260.29 |
| Molecular Formula: | C14 H16 N2 O3 |
| Smiles: | C1C=CCC(C1C(O)=O)C(NCc1ccncc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.242 |
| logD: | -2.1138 |
| logSw: | -1.4622 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.68 |
| InChI Key: | WHQJJCMFRKVKNY-UHFFFAOYSA-N |