4-[3-(4-ethyl-4H-1,2,4-triazol-3-yl)-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl]phthalazin-1(2H)-one
Chemical Structure Depiction of
4-[3-(4-ethyl-4H-1,2,4-triazol-3-yl)-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl]phthalazin-1(2H)-one
4-[3-(4-ethyl-4H-1,2,4-triazol-3-yl)-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl]phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | S565-0638 |
| Compound Name: | 4-[3-(4-ethyl-4H-1,2,4-triazol-3-yl)-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl]phthalazin-1(2H)-one |
| Molecular Weight: | 404.43 |
| Molecular Formula: | C20 H20 N8 O2 |
| Smiles: | CCn1cnnc1c1c2CN(CCc2n(C)n1)C(C1c2ccccc2C(NN=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.2529 |
| logD: | -0.5244 |
| logSw: | -2.3617 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.038 |
| InChI Key: | OUHYWJWIUHTBAP-UHFFFAOYSA-N |