5-(2,5-dimethoxybenzene-1-sulfonyl)-9-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-(2,5-dimethoxybenzene-1-sulfonyl)-9-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
5-(2,5-dimethoxybenzene-1-sulfonyl)-9-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S747-1446 |
| Compound Name: | 5-(2,5-dimethoxybenzene-1-sulfonyl)-9-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 516.58 |
| Molecular Formula: | C23 H28 N6 O6 S |
| Smiles: | COc1ccc(c(c1)S(N1CCCC(CCNC(CC1)=O)c1nc(c2cnccn2)no1)(=O)=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0415 |
| logD: | 1.0413 |
| logSw: | -2.0532 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 122.45 |
| InChI Key: | IWYODFSQHQJYIC-UHFFFAOYSA-N |