6-bromo-N-[(3-methoxyphenyl)methyl]-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-N-[(3-methoxyphenyl)methyl]-2H-1-benzopyran-3-carboxamide
6-bromo-N-[(3-methoxyphenyl)methyl]-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | G669-1166 |
| Compound Name: | 6-bromo-N-[(3-methoxyphenyl)methyl]-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 374.23 |
| Molecular Formula: | C18 H16 Br N O3 |
| Smiles: | COc1cccc(CNC(C2COc3ccc(cc3C=2)[Br])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.053 |
| logD: | 4.053 |
| logSw: | -4.2858 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.565 |
| InChI Key: | YRGUCGQDTVEEBR-UHFFFAOYSA-N |