N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-propyl-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-propyl-1,2-oxazole-3-carboxamide
N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-propyl-1,2-oxazole-3-carboxamide
Compound characteristics
Compound ID: | C226-3075 |
Compound Name: | N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-propyl-1,2-oxazole-3-carboxamide |
Molecular Weight: | 407.3 |
Molecular Formula: | C19 H20 Cl2 N4 O2 |
Smiles: | CCCc1cc(C(Nc2c(C)nn(Cc3c(cccc3[Cl])[Cl])c2C)=O)no1 |
Stereo: | ACHIRAL |
logP: | 4.1381 |
logD: | 4.1379 |
logSw: | -4.4354 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.193 |
InChI Key: | CBJGSYZQJIGJAJ-UHFFFAOYSA-N |