2-(3,5-dimethoxyphenyl)-1-[4-(methanesulfonyl)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(3,5-dimethoxyphenyl)-1-[4-(methanesulfonyl)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one
2-(3,5-dimethoxyphenyl)-1-[4-(methanesulfonyl)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | S990-0472 |
| Compound Name: | 2-(3,5-dimethoxyphenyl)-1-[4-(methanesulfonyl)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one |
| Molecular Weight: | 438.5 |
| Molecular Formula: | C19 H26 N4 O6 S |
| Smiles: | Cc1nc(C2CCN(CCN2S(C)(=O)=O)C(Cc2cc(cc(c2)OC)OC)=O)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2922 |
| logD: | 1.2922 |
| logSw: | -2.0212 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 94.822 |
| InChI Key: | FUJGRZNCWVOGMB-KRWDZBQOSA-N |