N-(4-chloro-2-methylphenyl)-4-[(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzamide
Chemical Structure Depiction of
N-(4-chloro-2-methylphenyl)-4-[(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzamide
N-(4-chloro-2-methylphenyl)-4-[(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzamide
Compound characteristics
Compound ID: | E856-1953 |
Compound Name: | N-(4-chloro-2-methylphenyl)-4-[(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzamide |
Molecular Weight: | 408.89 |
Molecular Formula: | C22 H21 Cl N4 O2 |
Smiles: | Cc1cc(ccc1NC(c1ccc(CN2C(CCn3c2cc(C)n3)=O)cc1)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 3.8012 |
logD: | 3.7921 |
logSw: | -4.2959 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.492 |
InChI Key: | NBZHPKQLQOIAPG-UHFFFAOYSA-N |