(1RS)-1-({2-[5-(3,4-difluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-sulfonyl}methyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-one
Chemical Structure Depiction of
(1RS)-1-({2-[5-(3,4-difluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-sulfonyl}methyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-one
(1RS)-1-({2-[5-(3,4-difluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-sulfonyl}methyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-one
Compound characteristics
| Compound ID: | V005-3635 |
| Compound Name: | (1RS)-1-({2-[5-(3,4-difluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-sulfonyl}methyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-one |
| Molecular Weight: | 514.59 |
| Molecular Formula: | C27 H28 F2 N2 O4 S |
| Smiles: | CC1(C)C2CC[C@]1(CS(N1CCCC1c1nc3cc(ccc3o1)c1ccc(c(c1)F)F)(=O)=O)C(C2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.8549 |
| logD: | 5.8549 |
| logSw: | -5.4316 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.312 |
| InChI Key: | FMRDODQGOHRDKP-RQSRLPFNSA-N |