N-(4-bromo-3-methylphenyl)-N~2~-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N~2~-methylglycinamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-N~2~-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N~2~-methylglycinamide
N-(4-bromo-3-methylphenyl)-N~2~-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N~2~-methylglycinamide
Compound characteristics
| Compound ID: | G938-1311 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-N~2~-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N~2~-methylglycinamide |
| Molecular Weight: | 496.38 |
| Molecular Formula: | C20 H22 Br N3 O5 S |
| Smiles: | CC1C(Nc2cc(C)c(cc2O1)S(N(C)CC(Nc1ccc(c(C)c1)[Br])=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4196 |
| logD: | 3.4189 |
| logSw: | -3.7103 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.561 |
| InChI Key: | CRXFKFJDKUPYIL-CYBMUJFWSA-N |