6-bromo-N-[(4-ethoxy-3-methoxyphenyl)methyl]-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-N-[(4-ethoxy-3-methoxyphenyl)methyl]-2H-1-benzopyran-3-carboxamide
6-bromo-N-[(4-ethoxy-3-methoxyphenyl)methyl]-2H-1-benzopyran-3-carboxamide
Compound characteristics
Compound ID: | G669-1293 |
Compound Name: | 6-bromo-N-[(4-ethoxy-3-methoxyphenyl)methyl]-2H-1-benzopyran-3-carboxamide |
Molecular Weight: | 418.29 |
Molecular Formula: | C20 H20 Br N O4 |
Smiles: | CCOc1ccc(CNC(C2COc3ccc(cc3C=2)[Br])=O)cc1OC |
Stereo: | ACHIRAL |
logP: | 3.9162 |
logD: | 3.9162 |
logSw: | -4.0352 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.862 |
InChI Key: | YGAIHNLAWNUTOH-UHFFFAOYSA-N |