N-[(5-bromo-2-methoxyphenyl)methyl]-4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
N-[(5-bromo-2-methoxyphenyl)methyl]-4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
Compound characteristics
| Compound ID: | E014-0295 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide |
| Molecular Weight: | 470.39 |
| Molecular Formula: | C22 H20 Br N3 O2 S |
| Smiles: | Cc1cc(C)nc2c1c(c(C(NCc1cc(ccc1OC)[Br])=O)s2)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5308 |
| logD: | 5.522 |
| logSw: | -5.7158 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.193 |
| InChI Key: | JPDQJECRKMACNO-UHFFFAOYSA-N |