3-(5-bromothiophen-2-yl)-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
3-(5-bromothiophen-2-yl)-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-1H-pyrazole-5-carboxamide
3-(5-bromothiophen-2-yl)-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y043-3422 |
| Compound Name: | 3-(5-bromothiophen-2-yl)-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 429.3 |
| Molecular Formula: | C17 H13 Br N6 O S |
| Smiles: | C(c1ccc(cc1)NC(c1cc(c2ccc(s2)[Br])n[nH]1)=O)n1cncn1 |
| Stereo: | ACHIRAL |
| logP: | 3.199 |
| logD: | 3.199 |
| logSw: | -3.3537 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.814 |
| InChI Key: | ISTQUCYMGIHCBY-UHFFFAOYSA-N |