5-(4-fluoro-3-methylphenyl)-2-[1-(4-nitrobenzene-1-sulfonyl)pyrrolidin-2-yl]-1,3-benzoxazole
Chemical Structure Depiction of
5-(4-fluoro-3-methylphenyl)-2-[1-(4-nitrobenzene-1-sulfonyl)pyrrolidin-2-yl]-1,3-benzoxazole
5-(4-fluoro-3-methylphenyl)-2-[1-(4-nitrobenzene-1-sulfonyl)pyrrolidin-2-yl]-1,3-benzoxazole
Compound characteristics
| Compound ID: | V018-0366 |
| Compound Name: | 5-(4-fluoro-3-methylphenyl)-2-[1-(4-nitrobenzene-1-sulfonyl)pyrrolidin-2-yl]-1,3-benzoxazole |
| Molecular Weight: | 481.5 |
| Molecular Formula: | C24 H20 F N3 O5 S |
| Smiles: | Cc1cc(ccc1F)c1ccc2c(c1)nc(C1CCCN1S(c1ccc(cc1)[N+]([O-])=O)(=O)=O)o2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5957 |
| logD: | 5.5957 |
| logSw: | -5.4994 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.706 |
| InChI Key: | FRVPOXAAQQCDLK-QFIPXVFZSA-N |