6-bromo-8-methoxy-N-[(4-methoxyphenyl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-8-methoxy-N-[(4-methoxyphenyl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide
6-bromo-8-methoxy-N-[(4-methoxyphenyl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
Compound ID: | 8016-2131 |
Compound Name: | 6-bromo-8-methoxy-N-[(4-methoxyphenyl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide |
Molecular Weight: | 418.24 |
Molecular Formula: | C19 H16 Br N O5 |
Smiles: | COc1ccc(CNC(C2=Cc3cc(cc(c3OC2=O)OC)[Br])=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.324 |
logD: | 3.324 |
logSw: | -3.669 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.432 |
InChI Key: | SQKLATTUDXXMRR-UHFFFAOYSA-N |