N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydropyrazolo[1,5-a]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydropyrazolo[1,5-a]quinazoline-3-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydropyrazolo[1,5-a]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | J035-0436 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydropyrazolo[1,5-a]quinazoline-3-carboxamide |
| Molecular Weight: | 431.54 |
| Molecular Formula: | C25 H29 N5 O2 |
| Smiles: | CC1(C)CC2=C(C=Nc3c(cnn23)C(NCCCN2CCc3ccccc3C2)=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0797 |
| logD: | 1.9299 |
| logSw: | -3.3583 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.548 |
| InChI Key: | HSNFZWBFYICZEH-UHFFFAOYSA-N |