3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}propanamide
Chemical Structure Depiction of
3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}propanamide
3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}propanamide
Compound characteristics
| Compound ID: | Y044-5166 |
| Compound Name: | 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}propanamide |
| Molecular Weight: | 377.47 |
| Molecular Formula: | C20 H19 N5 O S |
| Smiles: | C(C(c1ccsc1)n1cccc1)C(Nc1ccc(Cn2cncn2)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6187 |
| logD: | 2.6186 |
| logSw: | -2.9223 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.634 |
| InChI Key: | LPKAUFFQMLNIPA-IBGZPJMESA-N |