1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-2-phenylethan-1-one
Chemical Structure Depiction of
1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-2-phenylethan-1-one
1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-2-phenylethan-1-one
Compound characteristics
| Compound ID: | S565-0430 |
| Compound Name: | 1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-2-phenylethan-1-one |
| Molecular Weight: | 336.39 |
| Molecular Formula: | C18 H20 N6 O |
| Smiles: | Cn1cnnc1c1c2CN(CCc2n(C)n1)C(Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5926 |
| logD: | 0.5875 |
| logSw: | -1.3792 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.951 |
| InChI Key: | KMRSHKZZDYNVHH-UHFFFAOYSA-N |