ethyl 3-[(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 3-[(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)amino]benzoate
ethyl 3-[(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)amino]benzoate
Compound characteristics
| Compound ID: | E245-0328 |
| Compound Name: | ethyl 3-[(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)amino]benzoate |
| Molecular Weight: | 390.41 |
| Molecular Formula: | C18 H18 N2 O6 S |
| Smiles: | CCOC(c1cccc(c1)NS(c1cc2c(cc1C)NC(CO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.749 |
| logD: | 2.7357 |
| logSw: | -3.1483 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.912 |
| InChI Key: | BBXYLFBSWQMTPX-UHFFFAOYSA-N |