3-{(2S)-1-oxo-1-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]propan-2-yl}-1,2,3-benzotriazin-4(3H)-one
Chemical Structure Depiction of
3-{(2S)-1-oxo-1-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]propan-2-yl}-1,2,3-benzotriazin-4(3H)-one
3-{(2S)-1-oxo-1-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]propan-2-yl}-1,2,3-benzotriazin-4(3H)-one
Compound characteristics
| Compound ID: | Y041-4303 |
| Compound Name: | 3-{(2S)-1-oxo-1-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]propan-2-yl}-1,2,3-benzotriazin-4(3H)-one |
| Molecular Weight: | 403.44 |
| Molecular Formula: | C21 H21 N7 O2 |
| Smiles: | C[C@@H](C(N1CCC(CC1)c1nnc2ccccn12)=O)N1C(c2ccccc2N=N1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.9699 |
| logD: | 1.9699 |
| logSw: | -2.5399 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 77.724 |
| InChI Key: | BLZOJNUCNUQXJO-AWEZNQCLSA-N |