(2-hydroxypyridin-4-yl){3-[1-(methanesulfonyl)piperidin-2-yl]-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepin-7-yl}methanone
Chemical Structure Depiction of
(2-hydroxypyridin-4-yl){3-[1-(methanesulfonyl)piperidin-2-yl]-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepin-7-yl}methanone
(2-hydroxypyridin-4-yl){3-[1-(methanesulfonyl)piperidin-2-yl]-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepin-7-yl}methanone
Compound characteristics
| Compound ID: | S923-0517 |
| Compound Name: | (2-hydroxypyridin-4-yl){3-[1-(methanesulfonyl)piperidin-2-yl]-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepin-7-yl}methanone |
| Molecular Weight: | 420.49 |
| Molecular Formula: | C18 H24 N6 O4 S |
| Smiles: | CS(N1CCCCC1c1nnc2CCN(CCn12)C(c1ccnc(c1)O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.8407 |
| logD: | -0.9031 |
| logSw: | -1.6699 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.971 |
| InChI Key: | XOJBCGAHQOYKPX-AWEZNQCLSA-N |