4-[(5-oxo-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)benzamide
Chemical Structure Depiction of
4-[(5-oxo-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)benzamide
4-[(5-oxo-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)benzamide
Compound characteristics
| Compound ID: | E856-2421 |
| Compound Name: | 4-[(5-oxo-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)benzamide |
| Molecular Weight: | 494.59 |
| Molecular Formula: | C30 H30 N4 O3 |
| Smiles: | CC(C)Oc1ccc(CNC(c2ccc(CN3C(CCn4c3cc(c3ccccc3)n4)=O)cc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.981 |
| logD: | 4.981 |
| logSw: | -4.5502 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.237 |
| InChI Key: | KZMSXCUBAQKBBN-UHFFFAOYSA-N |