N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3,7-dimethyl-1-(4-methylphenyl)-6-oxo-6,7-dihydro-1H-pyrazolo[3,4-b]pyrazin-5-yl]propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3,7-dimethyl-1-(4-methylphenyl)-6-oxo-6,7-dihydro-1H-pyrazolo[3,4-b]pyrazin-5-yl]propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3,7-dimethyl-1-(4-methylphenyl)-6-oxo-6,7-dihydro-1H-pyrazolo[3,4-b]pyrazin-5-yl]propanamide
Compound characteristics
| Compound ID: | G426-0027 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3,7-dimethyl-1-(4-methylphenyl)-6-oxo-6,7-dihydro-1H-pyrazolo[3,4-b]pyrazin-5-yl]propanamide |
| Molecular Weight: | 459.5 |
| Molecular Formula: | C25 H25 N5 O4 |
| Smiles: | Cc1ccc(cc1)n1c2c(c(C)n1)N=C(CCC(NCc1ccc3c(c1)OCO3)=O)C(N2C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4629 |
| logD: | 2.4629 |
| logSw: | -2.9506 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.878 |
| InChI Key: | BDQJDKHKJGEZGV-UHFFFAOYSA-N |