1-[4-(4-fluoro-3-methylbenzene-1-sulfonyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]propan-1-one
Chemical Structure Depiction of
1-[4-(4-fluoro-3-methylbenzene-1-sulfonyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]propan-1-one
1-[4-(4-fluoro-3-methylbenzene-1-sulfonyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]propan-1-one
Compound characteristics
| Compound ID: | SA52-0569 |
| Compound Name: | 1-[4-(4-fluoro-3-methylbenzene-1-sulfonyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]propan-1-one |
| Molecular Weight: | 410.47 |
| Molecular Formula: | C18 H23 F N4 O4 S |
| Smiles: | CCC(N1CCCN(CC1c1nc(C)no1)S(c1ccc(c(C)c1)F)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2245 |
| logD: | 2.2245 |
| logSw: | -2.6653 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.398 |
| InChI Key: | QORJJPDEXMNLLB-INIZCTEOSA-N |