1-(4-{4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
1-(4-{4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | M036-0282 |
| Compound Name: | 1-(4-{4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one |
| Molecular Weight: | 430.53 |
| Molecular Formula: | C24 H22 N4 O2 S |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(c1c(c2cccnc2s1)n1cccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7117 |
| logD: | 3.7026 |
| logSw: | -3.8873 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.51 |
| InChI Key: | MNRLUOOFYLMSQH-UHFFFAOYSA-N |