1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(trifluoromethyl)phenyl]prolinamide
Chemical Structure Depiction of
1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(trifluoromethyl)phenyl]prolinamide
1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(trifluoromethyl)phenyl]prolinamide
Compound characteristics
| Compound ID: | F632-0157 |
| Compound Name: | 1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(trifluoromethyl)phenyl]prolinamide |
| Molecular Weight: | 483.46 |
| Molecular Formula: | C21 H20 F3 N3 O5 S |
| Smiles: | Cc1cc2c(cc1S(N1CCCC1C(Nc1ccc(cc1)C(F)(F)F)=O)(=O)=O)OCC(N2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5293 |
| logD: | 2.5288 |
| logSw: | -2.9928 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.148 |
| InChI Key: | WTQCPKCRBAJHIT-INIZCTEOSA-N |