N-[3-(4-benzylpiperazin-1-yl)propyl]-4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperazin-1-yl)propyl]-4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
N-[3-(4-benzylpiperazin-1-yl)propyl]-4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
Compound characteristics
| Compound ID: | E014-0237 |
| Compound Name: | N-[3-(4-benzylpiperazin-1-yl)propyl]-4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide |
| Molecular Weight: | 487.67 |
| Molecular Formula: | C28 H33 N5 O S |
| Smiles: | Cc1cc(C)nc2c1c(c(C(NCCCN1CCN(CC1)Cc1ccccc1)=O)s2)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2446 |
| logD: | 3.4737 |
| logSw: | -4.3148 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.927 |
| InChI Key: | YLBMPPZNEBRJDE-UHFFFAOYSA-N |