methyl 4-{[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 4-{[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]carbamamido}benzoate
methyl 4-{[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]carbamamido}benzoate
Compound characteristics
| Compound ID: | Y043-6338 |
| Compound Name: | methyl 4-{[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]carbamamido}benzoate |
| Molecular Weight: | 325.32 |
| Molecular Formula: | C16 H15 N5 O3 |
| Smiles: | COC(c1ccc(cc1)NC(NCc1nnc2ccccn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2906 |
| logD: | 1.2906 |
| logSw: | -1.8025 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.624 |
| InChI Key: | PITDZKAFEDCEQS-UHFFFAOYSA-N |