N-(4-bromo-3-methylphenyl)-3-(propan-2-yl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-3-(propan-2-yl)-1H-pyrazole-5-carboxamide
N-(4-bromo-3-methylphenyl)-3-(propan-2-yl)-1H-pyrazole-5-carboxamide
Compound characteristics
Compound ID: | C301-1471 |
Compound Name: | N-(4-bromo-3-methylphenyl)-3-(propan-2-yl)-1H-pyrazole-5-carboxamide |
Molecular Weight: | 322.2 |
Molecular Formula: | C14 H16 Br N3 O |
Smiles: | CC(C)c1cc(C(Nc2ccc(c(C)c2)[Br])=O)[nH]n1 |
Stereo: | ACHIRAL |
logP: | 4.173 |
logD: | 4.1724 |
logSw: | -4.2047 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 46.091 |
InChI Key: | KWIPFQOIEYNOLZ-UHFFFAOYSA-N |