methyl 2-[(4-acetyl-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(4-acetyl-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)amino]benzoate
methyl 2-[(4-acetyl-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)amino]benzoate
Compound characteristics
| Compound ID: | E470-1399 |
| Compound Name: | methyl 2-[(4-acetyl-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)amino]benzoate |
| Molecular Weight: | 404.44 |
| Molecular Formula: | C19 H20 N2 O6 S |
| Smiles: | CC(N1CCOc2cc(c(C)cc12)S(Nc1ccccc1C(=O)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4483 |
| logD: | 0.6147 |
| logSw: | -2.953 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.368 |
| InChI Key: | UOAKMFYWHSHLJM-UHFFFAOYSA-N |