3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-6-methyl-1-(4-methylphenyl)-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-6-methyl-1-(4-methylphenyl)-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-6-methyl-1-(4-methylphenyl)-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | L090-3353 |
| Compound Name: | 3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-6-methyl-1-(4-methylphenyl)-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 486.53 |
| Molecular Formula: | C26 H26 N6 O4 |
| Smiles: | Cc1ccc(cc1)n1c2C(N(C)C=Nc2c(C(N2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7169 |
| logD: | 1.5236 |
| logSw: | -2.2287 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.63 |
| InChI Key: | VJMFWTLKWUXEQV-UHFFFAOYSA-N |