4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
Chemical Structure Depiction of
4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
Compound characteristics
| Compound ID: | E856-3191 |
| Compound Name: | 4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide |
| Molecular Weight: | 511.02 |
| Molecular Formula: | C30 H27 Cl N4 O2 |
| Smiles: | C1CC(c2ccccc2C1)NC(c1ccc(CN2C(CCn3c2cc(c2ccc(cc2)[Cl])n3)=O)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0074 |
| logD: | 6.0071 |
| logSw: | -6.259 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.278 |
| InChI Key: | IUBFKYVZIFUALO-SANMLTNESA-N |