N-[1-(4-bromophenyl)-3-tert-butyl-1H-pyrazol-5-yl]-3-fluorobenzamide
Chemical Structure Depiction of
N-[1-(4-bromophenyl)-3-tert-butyl-1H-pyrazol-5-yl]-3-fluorobenzamide
N-[1-(4-bromophenyl)-3-tert-butyl-1H-pyrazol-5-yl]-3-fluorobenzamide
Compound characteristics
| Compound ID: | V031-0807 |
| Compound Name: | N-[1-(4-bromophenyl)-3-tert-butyl-1H-pyrazol-5-yl]-3-fluorobenzamide |
| Molecular Weight: | 416.29 |
| Molecular Formula: | C20 H19 Br F N3 O |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1cc(NC(c2cccc(c2)F)=O)n(c2ccc(cc2)[Br])n1 |
| Stereo: | ACHIRAL |
| logP: | 5.8965 |
| logD: | 5.8684 |
| logSw: | -5.5761 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.765 |
| InChI Key: | RSQPWNGAIXOOIN-UHFFFAOYSA-N |