ethyl 2,5-dimethyl-1-[(4-{[(pyridin-3-yl)methyl]carbamoyl}cyclohexyl)methyl]-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 2,5-dimethyl-1-[(4-{[(pyridin-3-yl)methyl]carbamoyl}cyclohexyl)methyl]-1H-pyrrole-3-carboxylate
ethyl 2,5-dimethyl-1-[(4-{[(pyridin-3-yl)methyl]carbamoyl}cyclohexyl)methyl]-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | E786-1269 |
| Compound Name: | ethyl 2,5-dimethyl-1-[(4-{[(pyridin-3-yl)methyl]carbamoyl}cyclohexyl)methyl]-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 397.52 |
| Molecular Formula: | C23 H31 N3 O3 |
| Smiles: | CCOC(c1cc(C)n(CC2CCC(CC2)C(NCc2cccnc2)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2111 |
| logD: | 3.2087 |
| logSw: | -3.0127 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.037 |
| InChI Key: | QEQZAIOHKFSBGV-UHFFFAOYSA-N |