methyl 3-{[1-(6-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidine-3-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[1-(6-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidine-3-carbonyl]amino}benzoate
methyl 3-{[1-(6-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidine-3-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | T403-0556 |
| Compound Name: | methyl 3-{[1-(6-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidine-3-carbonyl]amino}benzoate |
| Molecular Weight: | 413.86 |
| Molecular Formula: | C20 H20 Cl N5 O3 |
| Smiles: | COC(c1cccc(c1)NC(C1CCCN(C1)c1nnc2ccc(cn12)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1566 |
| logD: | 3.1565 |
| logSw: | -3.5944 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.933 |
| InChI Key: | SPHIODQGFLBMCS-AWEZNQCLSA-N |