methyl 4-[3-(3,7-dimethyl-6-oxo-1-phenyl-6,7-dihydro-1H-pyrazolo[3,4-b]pyrazin-5-yl)propanamido]benzoate
Chemical Structure Depiction of
methyl 4-[3-(3,7-dimethyl-6-oxo-1-phenyl-6,7-dihydro-1H-pyrazolo[3,4-b]pyrazin-5-yl)propanamido]benzoate
methyl 4-[3-(3,7-dimethyl-6-oxo-1-phenyl-6,7-dihydro-1H-pyrazolo[3,4-b]pyrazin-5-yl)propanamido]benzoate
Compound characteristics
| Compound ID: | G426-0181 |
| Compound Name: | methyl 4-[3-(3,7-dimethyl-6-oxo-1-phenyl-6,7-dihydro-1H-pyrazolo[3,4-b]pyrazin-5-yl)propanamido]benzoate |
| Molecular Weight: | 445.48 |
| Molecular Formula: | C24 H23 N5 O4 |
| Smiles: | Cc1c2c(N(C)C(C(CCC(Nc3ccc(cc3)C(=O)OC)=O)=N2)=O)n(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.3953 |
| logD: | 2.395 |
| logSw: | -2.8154 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.615 |
| InChI Key: | SVKFETKGILXGFE-UHFFFAOYSA-N |