N-butyl-2-{4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperazin-1-yl}acetamide
Chemical Structure Depiction of
N-butyl-2-{4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperazin-1-yl}acetamide
N-butyl-2-{4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperazin-1-yl}acetamide
Compound characteristics
| Compound ID: | M036-0292 |
| Compound Name: | N-butyl-2-{4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperazin-1-yl}acetamide |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C22 H27 N5 O2 S |
| Smiles: | CCCCNC(CN1CCN(CC1)C(c1c(c2cccnc2s1)n1cccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0224 |
| logD: | 3.0134 |
| logSw: | -3.052 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.548 |
| InChI Key: | NAQFWHCBBBYBKW-UHFFFAOYSA-N |