N-[(5-bromo-2-methoxyphenyl)methyl]-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-2H-1-benzopyran-3-carboxamide
N-[(5-bromo-2-methoxyphenyl)methyl]-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | G669-0960 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 374.23 |
| Molecular Formula: | C18 H16 Br N O3 |
| Smiles: | COc1ccc(cc1CNC(C1COc2ccccc2C=1)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.1097 |
| logD: | 4.1097 |
| logSw: | -4.3812 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.652 |
| InChI Key: | XECOWOFMHDRZTK-UHFFFAOYSA-N |