[1-methyl-3-(4-phenyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]{5-methyl-4-[(piperidin-1-yl)methyl]-1,2-oxazol-3-yl}methanone
Chemical Structure Depiction of
[1-methyl-3-(4-phenyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]{5-methyl-4-[(piperidin-1-yl)methyl]-1,2-oxazol-3-yl}methanone
[1-methyl-3-(4-phenyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]{5-methyl-4-[(piperidin-1-yl)methyl]-1,2-oxazol-3-yl}methanone
Compound characteristics
| Compound ID: | S565-1578 |
| Compound Name: | [1-methyl-3-(4-phenyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]{5-methyl-4-[(piperidin-1-yl)methyl]-1,2-oxazol-3-yl}methanone |
| Molecular Weight: | 486.58 |
| Molecular Formula: | C26 H30 N8 O2 |
| Smiles: | Cc1c(CN2CCCCC2)c(C(N2CCc3c(C2)c(c2nncn2c2ccccc2)nn3C)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 1.5798 |
| logD: | -3.8876 |
| logSw: | -1.9635 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 82.075 |
| InChI Key: | XMWPNTOOVLTUKR-UHFFFAOYSA-N |