1-[7-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(phenylmethanesulfonyl)-1,4-diazepan-1-yl]ethan-1-one
Chemical Structure Depiction of
1-[7-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(phenylmethanesulfonyl)-1,4-diazepan-1-yl]ethan-1-one
1-[7-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(phenylmethanesulfonyl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | S990-0512 |
| Compound Name: | 1-[7-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(phenylmethanesulfonyl)-1,4-diazepan-1-yl]ethan-1-one |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C17 H22 N4 O4 S |
| Smiles: | CC(N1CCN(CCC1c1nc(C)no1)S(Cc1ccccc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9199 |
| logD: | 0.9199 |
| logSw: | -2.0262 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.354 |
| InChI Key: | WBNSXRUHECXQNX-MRXNPFEDSA-N |