(3,5-dimethyl-1,2-oxazol-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
(3,5-dimethyl-1,2-oxazol-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
(3,5-dimethyl-1,2-oxazol-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: | S923-0580 |
| Compound Name: | (3,5-dimethyl-1,2-oxazol-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: | 422.5 |
| Molecular Formula: | C18 H26 N6 O4 S |
| Smiles: | Cc1c(C(N2CCc3nnc(C4CCCCN4S(C)(=O)=O)n3CC2)=O)c(C)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.1891 |
| logD: | -0.2132 |
| logSw: | -1.259 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 95.703 |
| InChI Key: | HFEYDXAUTTUZTA-AWEZNQCLSA-N |