N-[1-(4-bromophenyl)-3-tert-butyl-1H-pyrazol-5-yl]-3-methylbenzamide
Chemical Structure Depiction of
N-[1-(4-bromophenyl)-3-tert-butyl-1H-pyrazol-5-yl]-3-methylbenzamide
N-[1-(4-bromophenyl)-3-tert-butyl-1H-pyrazol-5-yl]-3-methylbenzamide
Compound characteristics
| Compound ID: | V012-1298 |
| Compound Name: | N-[1-(4-bromophenyl)-3-tert-butyl-1H-pyrazol-5-yl]-3-methylbenzamide |
| Molecular Weight: | 412.33 |
| Molecular Formula: | C21 H22 Br N3 O |
| Smiles: | Cc1cccc(c1)C(Nc1cc(C(C)(C)C)nn1c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.1449 |
| logD: | 6.1324 |
| logSw: | -5.5019 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.765 |
| InChI Key: | QZPNWSGQUJUJQK-UHFFFAOYSA-N |