ethyl 3,5-dimethyl-4-[(pyridin-4-yl)carbamoyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-[(pyridin-4-yl)carbamoyl]-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-[(pyridin-4-yl)carbamoyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | IB06-5710 |
| Compound Name: | ethyl 3,5-dimethyl-4-[(pyridin-4-yl)carbamoyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 287.32 |
| Molecular Formula: | C15 H17 N3 O3 |
| Smiles: | CCOC(c1c(C)c(C(Nc2ccncc2)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.94 |
| logD: | 1.92 |
| logSw: | -2.69 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.57 |
| InChI Key: | RMVHCNIREBGQSG-UHFFFAOYSA-N |