4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[3-(morpholin-4-yl)propyl]benzamide
Chemical Structure Depiction of
4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[3-(morpholin-4-yl)propyl]benzamide
4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[3-(morpholin-4-yl)propyl]benzamide
Compound characteristics
| Compound ID: | E856-3168 |
| Compound Name: | 4-{[2-(4-chlorophenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}-N-[3-(morpholin-4-yl)propyl]benzamide |
| Molecular Weight: | 508.02 |
| Molecular Formula: | C27 H30 Cl N5 O3 |
| Smiles: | C(CNC(c1ccc(CN2C(CCn3c2cc(c2ccc(cc2)[Cl])n3)=O)cc1)=O)CN1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.2098 |
| logD: | 2.8215 |
| logSw: | -3.7748 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.167 |
| InChI Key: | LXULUABWKAQHKW-UHFFFAOYSA-N |