benzyl 4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxylate
Chemical Structure Depiction of
benzyl 4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxylate
benzyl 4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxylate
Compound characteristics
| Compound ID: | 8018-8025 |
| Compound Name: | benzyl 4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxylate |
| Molecular Weight: | 362.45 |
| Molecular Formula: | C21 H18 N2 O2 S |
| Smiles: | Cc1cc(C)nc2c1c(c(C(=O)OCc1ccccc1)s2)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.272 |
| logD: | 5.2481 |
| logSw: | -5.4683 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.007 |
| InChI Key: | YFWUSZNIKJXTKU-UHFFFAOYSA-N |