4-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-[4-(methylsulfanyl)phenyl]-3,6-dihydropyridine-1(2H)-carboxamide
Chemical Structure Depiction of
4-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-[4-(methylsulfanyl)phenyl]-3,6-dihydropyridine-1(2H)-carboxamide
4-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-[4-(methylsulfanyl)phenyl]-3,6-dihydropyridine-1(2H)-carboxamide
Compound characteristics
| Compound ID: | P114-0923 |
| Compound Name: | 4-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-[4-(methylsulfanyl)phenyl]-3,6-dihydropyridine-1(2H)-carboxamide |
| Molecular Weight: | 392.52 |
| Molecular Formula: | C22 H24 N4 O S |
| Smiles: | CCn1cc(C2CCN(CC=2)C(Nc2ccc(cc2)SC)=O)c2cccnc12 |
| Stereo: | ACHIRAL |
| logP: | 4.174 |
| logD: | 4.1733 |
| logSw: | -3.8792 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.071 |
| InChI Key: | RXLQNVIXTAIRKJ-UHFFFAOYSA-N |