3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-8,8-dimethyl-8,9-dihydropyrazolo[1,5-a]quinazolin-6(7H)-one
Chemical Structure Depiction of
3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-8,8-dimethyl-8,9-dihydropyrazolo[1,5-a]quinazolin-6(7H)-one
3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-8,8-dimethyl-8,9-dihydropyrazolo[1,5-a]quinazolin-6(7H)-one
Compound characteristics
| Compound ID: | J035-0360 |
| Compound Name: | 3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-8,8-dimethyl-8,9-dihydropyrazolo[1,5-a]quinazolin-6(7H)-one |
| Molecular Weight: | 461.52 |
| Molecular Formula: | C25 H27 N5 O4 |
| Smiles: | CC1(C)CC2=C(C=Nc3c(cnn23)C(N2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1638 |
| logD: | 1.9722 |
| logSw: | -2.8116 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.953 |
| InChI Key: | GVBCZJPCEJSKNM-UHFFFAOYSA-N |