3-cyano-N-(4-{5-methyl-4-[(4-methyl-1H-pyrazol-1-yl)methyl]-1,3-oxazol-2-yl}phenyl)benzamide
Chemical Structure Depiction of
3-cyano-N-(4-{5-methyl-4-[(4-methyl-1H-pyrazol-1-yl)methyl]-1,3-oxazol-2-yl}phenyl)benzamide
3-cyano-N-(4-{5-methyl-4-[(4-methyl-1H-pyrazol-1-yl)methyl]-1,3-oxazol-2-yl}phenyl)benzamide
Compound characteristics
Compound ID: | P471-0224 |
Compound Name: | 3-cyano-N-(4-{5-methyl-4-[(4-methyl-1H-pyrazol-1-yl)methyl]-1,3-oxazol-2-yl}phenyl)benzamide |
Molecular Weight: | 397.44 |
Molecular Formula: | C23 H19 N5 O2 |
Smiles: | Cc1cnn(Cc2c(C)oc(c3ccc(cc3)NC(c3cccc(C#N)c3)=O)n2)c1 |
Stereo: | ACHIRAL |
logP: | 3.23 |
logD: | 3.2297 |
logSw: | -3.3273 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.013 |
InChI Key: | CCYYDWLJGQCNLH-UHFFFAOYSA-N |