N-(3-fluoro-4-methylphenyl)-3-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)butanamide
Chemical Structure Depiction of
N-(3-fluoro-4-methylphenyl)-3-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)butanamide
N-(3-fluoro-4-methylphenyl)-3-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)butanamide
Compound characteristics
| Compound ID: | E667-1367 |
| Compound Name: | N-(3-fluoro-4-methylphenyl)-3-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)butanamide |
| Molecular Weight: | 420.46 |
| Molecular Formula: | C20 H21 F N2 O5 S |
| Smiles: | CC(CC(Nc1ccc(C)c(c1)F)=O)S(c1cc2c(cc1C)NC(CO2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5531 |
| logD: | 2.5502 |
| logSw: | -2.9991 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.159 |
| InChI Key: | OYYZDPYMWWDKPN-ZDUSSCGKSA-N |