[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](oxan-4-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](oxan-4-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](oxan-4-yl)methanone
Compound characteristics
Compound ID: | S565-1023 |
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](oxan-4-yl)methanone |
Molecular Weight: | 406.49 |
Molecular Formula: | C22 H26 N6 O2 |
Smiles: | Cn1c2CCN(Cc2c(c2nncn2Cc2ccccc2)n1)C(C1CCOCC1)=O |
Stereo: | ACHIRAL |
logP: | 1.0533 |
logD: | 1.0528 |
logSw: | -1.7305 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 63.752 |
InChI Key: | GAYIXZHAVZKZSR-UHFFFAOYSA-N |