[3-(4-benzyl-4H-1,2,4-triazol-3-yl)-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]{5-methyl-4-[(4-methylpiperidin-1-yl)methyl]-1,2-oxazol-3-yl}methanone
Chemical Structure Depiction of
[3-(4-benzyl-4H-1,2,4-triazol-3-yl)-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]{5-methyl-4-[(4-methylpiperidin-1-yl)methyl]-1,2-oxazol-3-yl}methanone
[3-(4-benzyl-4H-1,2,4-triazol-3-yl)-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]{5-methyl-4-[(4-methylpiperidin-1-yl)methyl]-1,2-oxazol-3-yl}methanone
Compound characteristics
| Compound ID: | S565-1545 |
| Compound Name: | [3-(4-benzyl-4H-1,2,4-triazol-3-yl)-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]{5-methyl-4-[(4-methylpiperidin-1-yl)methyl]-1,2-oxazol-3-yl}methanone |
| Molecular Weight: | 514.63 |
| Molecular Formula: | C28 H34 N8 O2 |
| Smiles: | CC1CCN(CC1)Cc1c(C(N2CCc3c(C2)c(c2nncn2Cc2ccccc2)nn3C)=O)noc1C |
| Stereo: | ACHIRAL |
| logP: | 1.9954 |
| logD: | -3.3356 |
| logSw: | -2.0912 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 81.615 |
| InChI Key: | BCTGLSZSPVLQBB-UHFFFAOYSA-N |