7-bromo-N-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
7-bromo-N-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
7-bromo-N-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
Compound ID: | D519-0405 |
Compound Name: | 7-bromo-N-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-4-oxo-4H-1-benzopyran-2-carboxamide |
Molecular Weight: | 443.25 |
Molecular Formula: | C20 H15 Br N2 O5 |
Smiles: | [H]N(C(C1=CC(c2ccc(cc2O1)[Br])=O)=O)c1ccc2c(c1)N(CC)C(CO2)=O |
Stereo: | ACHIRAL |
logP: | 3.4064 |
logD: | 3.3971 |
logSw: | -3.9613 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.974 |
InChI Key: | GLHQBIPIVNXJNV-UHFFFAOYSA-N |