4-[2-({5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}amino)ethyl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-[2-({5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}amino)ethyl]benzene-1-sulfonamide
4-[2-({5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}amino)ethyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | K405-0539 |
| Compound Name: | 4-[2-({5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}amino)ethyl]benzene-1-sulfonamide |
| Molecular Weight: | 537.56 |
| Molecular Formula: | C27 H22 F3 N5 O2 S |
| Smiles: | [H]N(CCc1ccc(cc1)S(N)(=O)=O)c1c2c(cn(c3cccc(c3)C(F)(F)F)c2ncn1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0667 |
| logD: | 4.8983 |
| logSw: | -5.1122 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.146 |
| InChI Key: | LKIRSDCVZHHPBF-UHFFFAOYSA-N |