2-[1-(4-tert-butylbenzene-1-sulfonyl)pyrrolidin-2-yl]-5-(2,4-difluorophenyl)-1,3-benzoxazole
Chemical Structure Depiction of
2-[1-(4-tert-butylbenzene-1-sulfonyl)pyrrolidin-2-yl]-5-(2,4-difluorophenyl)-1,3-benzoxazole
2-[1-(4-tert-butylbenzene-1-sulfonyl)pyrrolidin-2-yl]-5-(2,4-difluorophenyl)-1,3-benzoxazole
Compound characteristics
| Compound ID: | V006-3298 |
| Compound Name: | 2-[1-(4-tert-butylbenzene-1-sulfonyl)pyrrolidin-2-yl]-5-(2,4-difluorophenyl)-1,3-benzoxazole |
| Molecular Weight: | 496.58 |
| Molecular Formula: | C27 H26 F2 N2 O3 S |
| Smiles: | CC(C)(C)c1ccc(cc1)S(N1CCCC1c1nc2cc(ccc2o1)c1ccc(cc1F)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.2082 |
| logD: | 7.2082 |
| logSw: | -5.8246 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.325 |
| InChI Key: | PQGBBULCRJTRAO-DEOSSOPVSA-N |