{3-[1-(methanesulfonyl)piperidin-2-yl]-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepin-7-yl}(5-methyl-1,2-oxazol-3-yl)methanone
Chemical Structure Depiction of
{3-[1-(methanesulfonyl)piperidin-2-yl]-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepin-7-yl}(5-methyl-1,2-oxazol-3-yl)methanone
{3-[1-(methanesulfonyl)piperidin-2-yl]-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepin-7-yl}(5-methyl-1,2-oxazol-3-yl)methanone
Compound characteristics
| Compound ID: | S923-0486 |
| Compound Name: | {3-[1-(methanesulfonyl)piperidin-2-yl]-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepin-7-yl}(5-methyl-1,2-oxazol-3-yl)methanone |
| Molecular Weight: | 408.48 |
| Molecular Formula: | C17 H24 N6 O4 S |
| Smiles: | Cc1cc(C(N2CCc3nnc(C4CCCCN4S(C)(=O)=O)n3CC2)=O)no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.2301 |
| logD: | 0.2059 |
| logSw: | -1.5469 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 94.893 |
| InChI Key: | NWMHKOBOPKXQMR-AWEZNQCLSA-N |