1-[7-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(propane-1-sulfonyl)-1,4-diazepan-1-yl]ethan-1-one
Chemical Structure Depiction of
1-[7-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(propane-1-sulfonyl)-1,4-diazepan-1-yl]ethan-1-one
1-[7-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(propane-1-sulfonyl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | S990-0518 |
| Compound Name: | 1-[7-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(propane-1-sulfonyl)-1,4-diazepan-1-yl]ethan-1-one |
| Molecular Weight: | 330.4 |
| Molecular Formula: | C13 H22 N4 O4 S |
| Smiles: | CCCS(N1CCC(c2nc(C)no2)N(CC1)C(C)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3018 |
| logD: | 0.3018 |
| logSw: | -1.2505 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.626 |
| InChI Key: | VMBSNMGRWDMTLI-GFCCVEGCSA-N |