N-[2-(4-chlorophenyl)ethyl]-4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
N-[2-(4-chlorophenyl)ethyl]-4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
Compound characteristics
| Compound ID: | E014-0092 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide |
| Molecular Weight: | 409.94 |
| Molecular Formula: | C22 H20 Cl N3 O S |
| Smiles: | Cc1cc(C)nc2c1c(c(C(NCCc1ccc(cc1)[Cl])=O)s2)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1658 |
| logD: | 5.1569 |
| logSw: | -5.5693 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.404 |
| InChI Key: | SSMKHHOQCMVVRN-UHFFFAOYSA-N |