2-(3-methylphenyl)-1-{2-[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]piperidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3-methylphenyl)-1-{2-[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]piperidin-1-yl}ethan-1-one
2-(3-methylphenyl)-1-{2-[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]piperidin-1-yl}ethan-1-one
Compound characteristics
Compound ID: | M754-2042 |
Compound Name: | 2-(3-methylphenyl)-1-{2-[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]piperidin-1-yl}ethan-1-one |
Molecular Weight: | 361.45 |
Molecular Formula: | C21 H23 N5 O |
Smiles: | Cc1cccc(CC(N2CCCCC2c2nnc(c3cccnc3)[nH]2)=O)c1 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.6689 |
logD: | 2.5644 |
logSw: | -2.4878 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.084 |
InChI Key: | VANZULNUHPZJRL-SFHVURJKSA-N |