N-[(3-bromophenyl)methyl]-6-methoxy-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-6-methoxy-2H-1-benzopyran-3-carboxamide
N-[(3-bromophenyl)methyl]-6-methoxy-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | G669-0303 |
| Compound Name: | N-[(3-bromophenyl)methyl]-6-methoxy-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 374.23 |
| Molecular Formula: | C18 H16 Br N O3 |
| Smiles: | COc1ccc2c(C=C(CO2)C(NCc2cccc(c2)[Br])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.9738 |
| logD: | 3.9738 |
| logSw: | -4.2539 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.565 |
| InChI Key: | NABXXAHMTVTSBH-UHFFFAOYSA-N |