N-benzyl-3-[(2-{[(3-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-3-[(2-{[(3-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
N-benzyl-3-[(2-{[(3-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L860-0425 |
| Compound Name: | N-benzyl-3-[(2-{[(3-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 461.54 |
| Molecular Formula: | C24 H23 N5 O3 S |
| Smiles: | COc1cccc(CNC(CSc2nnc3ccc(cn23)C(NCc2ccccc2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.8044 |
| logD: | 2.8044 |
| logSw: | -3.3005 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.481 |
| InChI Key: | ODEYHZDUIRJSHF-UHFFFAOYSA-N |