3-(5-bromothiophen-2-yl)-N-[(1S)-2-hydroxy-1-phenylethyl]-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
3-(5-bromothiophen-2-yl)-N-[(1S)-2-hydroxy-1-phenylethyl]-1H-pyrazole-5-carboxamide
3-(5-bromothiophen-2-yl)-N-[(1S)-2-hydroxy-1-phenylethyl]-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y042-2048 |
| Compound Name: | 3-(5-bromothiophen-2-yl)-N-[(1S)-2-hydroxy-1-phenylethyl]-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 392.27 |
| Molecular Formula: | C16 H14 Br N3 O2 S |
| Smiles: | C([C@H](c1ccccc1)NC(c1cc(c2ccc(s2)[Br])n[nH]1)=O)O |
| Stereo: | ABSOLUTE |
| logP: | 3.788 |
| logD: | 3.7879 |
| logSw: | -4.0149 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.905 |
| InChI Key: | AXRLNYUMAXUMRE-ZDUSSCGKSA-N |