N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-3-(2,5-dimethyl-1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
Chemical Structure Depiction of
N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-3-(2,5-dimethyl-1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-3-(2,5-dimethyl-1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
Compound characteristics
| Compound ID: | G664-0538 |
| Compound Name: | N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-3-(2,5-dimethyl-1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide |
| Molecular Weight: | 487.67 |
| Molecular Formula: | C28 H33 N5 O S |
| Smiles: | Cc1cccc(c1C)N1CCN(CCNC(c2c(c3cccnc3s2)n2c(C)ccc2C)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.8691 |
| logD: | 4.6618 |
| logSw: | -4.594 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.875 |
| InChI Key: | JQJFQYLMZYOMQT-UHFFFAOYSA-N |