3-(5-chloro-2-methoxyanilino)-4-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(5-chloro-2-methoxyanilino)-4-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)cyclobut-3-ene-1,2-dione
3-(5-chloro-2-methoxyanilino)-4-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E786-0982 |
| Compound Name: | 3-(5-chloro-2-methoxyanilino)-4-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 384.77 |
| Molecular Formula: | C19 H13 Cl N2 O5 |
| Smiles: | COc1ccc(cc1NC1=C(C(C1=O)=O)c1ccc2c(c1)OCC(N2)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.7168 |
| logD: | 2.4864 |
| logSw: | -3.4561 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.097 |
| InChI Key: | UWVKDJADSKKLRL-UHFFFAOYSA-N |