ethyl 3-[(4-acetyl-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 3-[(4-acetyl-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)amino]benzoate
ethyl 3-[(4-acetyl-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)amino]benzoate
Compound characteristics
| Compound ID: | E470-2178 |
| Compound Name: | ethyl 3-[(4-acetyl-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)amino]benzoate |
| Molecular Weight: | 438.89 |
| Molecular Formula: | C19 H19 Cl N2 O6 S |
| Smiles: | CCOC(c1cccc(c1)NS(c1cc2c(cc1[Cl])N(CCO2)C(C)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4388 |
| logD: | 3.4361 |
| logSw: | -3.8992 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.645 |
| InChI Key: | ZVUAMCYSRBELAJ-UHFFFAOYSA-N |