3-methyl-5-[1-(4-nitrobenzene-1-sulfonyl)pyrrolidin-2-yl]-1,2-oxazole
Chemical Structure Depiction of
3-methyl-5-[1-(4-nitrobenzene-1-sulfonyl)pyrrolidin-2-yl]-1,2-oxazole
3-methyl-5-[1-(4-nitrobenzene-1-sulfonyl)pyrrolidin-2-yl]-1,2-oxazole
Compound characteristics
| Compound ID: | J005-0229 |
| Compound Name: | 3-methyl-5-[1-(4-nitrobenzene-1-sulfonyl)pyrrolidin-2-yl]-1,2-oxazole |
| Molecular Weight: | 337.35 |
| Molecular Formula: | C14 H15 N3 O5 S |
| Smiles: | Cc1cc(C2CCCN2S(c2ccc(cc2)[N+]([O-])=O)(=O)=O)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2482 |
| logD: | 2.2482 |
| logSw: | -2.5584 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.509 |
| InChI Key: | WGRLTFLTRRVGBS-ZDUSSCGKSA-N |