2-[1-(4-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]-5-[4-(trifluoromethyl)phenyl]-1,3-benzoxazole
Chemical Structure Depiction of
2-[1-(4-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]-5-[4-(trifluoromethyl)phenyl]-1,3-benzoxazole
2-[1-(4-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]-5-[4-(trifluoromethyl)phenyl]-1,3-benzoxazole
Compound characteristics
| Compound ID: | V009-9331 |
| Compound Name: | 2-[1-(4-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]-5-[4-(trifluoromethyl)phenyl]-1,3-benzoxazole |
| Molecular Weight: | 502.51 |
| Molecular Formula: | C25 H21 F3 N2 O4 S |
| Smiles: | COc1ccc(cc1)S(N1CCCC1c1nc2cc(ccc2o1)c1ccc(cc1)C(F)(F)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1259 |
| logD: | 6.1259 |
| logSw: | -5.6765 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.869 |
| InChI Key: | HNGQPEMNGZSJTI-QFIPXVFZSA-N |