3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]propanamide
Chemical Structure Depiction of
3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]propanamide
3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]propanamide
Compound characteristics
| Compound ID: | Y042-6280 |
| Compound Name: | 3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]propanamide |
| Molecular Weight: | 378.39 |
| Molecular Formula: | C19 H18 N6 O3 |
| Smiles: | C(C[C@@H]1C(Nc2ccccc2C(N1)=O)=O)C(NCc1nnc2ccccn12)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.3893 |
| logD: | 0.3788 |
| logSw: | -2.0552 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.008 |
| InChI Key: | UOMVPXGOPAXKKY-AWEZNQCLSA-N |