2-bromo-N-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]benzamide
Chemical Structure Depiction of
2-bromo-N-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]benzamide
2-bromo-N-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]benzamide
Compound characteristics
Compound ID: | 4334-0157 |
Compound Name: | 2-bromo-N-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]benzamide |
Molecular Weight: | 421.25 |
Molecular Formula: | C21 H13 Br N2 O3 |
Smiles: | c1ccc2c(c1)C(=O)OC(c1ccc(cc1)NC(c1ccccc1[Br])=O)=N2 |
Stereo: | ACHIRAL |
logP: | 3.8266 |
logD: | 3.8238 |
logSw: | -4.3929 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 53.277 |
InChI Key: | NYFKPMPGARDGCV-UHFFFAOYSA-N |