N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-[(5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-[(5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-[(5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzamide
Compound characteristics
| Compound ID: | E856-0200 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-[(5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzamide |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C26 H29 N5 O2 |
| Smiles: | C(CNC(c1ccc(CN2C(CCn3c2ccn3)=O)cc1)=O)CN1CCc2ccccc2C1 |
| Stereo: | ACHIRAL |
| logP: | 2.5314 |
| logD: | 1.3816 |
| logSw: | -2.7497 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.326 |
| InChI Key: | BBBCBHLFRUGIGC-UHFFFAOYSA-N |