1-{1-methyl-3-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}-2-(thiophen-3-yl)ethan-1-one
Chemical Structure Depiction of
1-{1-methyl-3-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}-2-(thiophen-3-yl)ethan-1-one
1-{1-methyl-3-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}-2-(thiophen-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | S565-0705 |
| Compound Name: | 1-{1-methyl-3-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}-2-(thiophen-3-yl)ethan-1-one |
| Molecular Weight: | 370.47 |
| Molecular Formula: | C18 H22 N6 O S |
| Smiles: | CC(C)n1cnnc1c1c2CN(CCc2n(C)n1)C(Cc1ccsc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2524 |
| logD: | 1.2007 |
| logSw: | -2.1168 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 57.205 |
| InChI Key: | ZWVOEUJBGKRVAH-UHFFFAOYSA-N |