1-[4-(2,4-difluorobenzene-1-sulfonyl)-7-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one
Chemical Structure Depiction of
1-[4-(2,4-difluorobenzene-1-sulfonyl)-7-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one
1-[4-(2,4-difluorobenzene-1-sulfonyl)-7-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | S990-0543 |
| Compound Name: | 1-[4-(2,4-difluorobenzene-1-sulfonyl)-7-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one |
| Molecular Weight: | 400.4 |
| Molecular Formula: | C16 H18 F2 N4 O4 S |
| Smiles: | CC(N1CCN(CCC1c1nc(C)no1)S(c1ccc(cc1F)F)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3615 |
| logD: | 1.3615 |
| logSw: | -2.3605 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.46 |
| InChI Key: | LWDFWTDFNZQGDT-CQSZACIVSA-N |