N-{3-[benzyl(methyl)amino]propyl}-6-bromo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-{3-[benzyl(methyl)amino]propyl}-6-bromo-2H-1-benzopyran-3-carboxamide
N-{3-[benzyl(methyl)amino]propyl}-6-bromo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | G669-1257 |
| Compound Name: | N-{3-[benzyl(methyl)amino]propyl}-6-bromo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 415.33 |
| Molecular Formula: | C21 H23 Br N2 O2 |
| Smiles: | CN(CCCNC(C1COc2ccc(cc2C=1)[Br])=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8469 |
| logD: | 2.4058 |
| logSw: | -3.9145 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.957 |
| InChI Key: | FQIAYVQUNMWLMA-UHFFFAOYSA-N |