N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(1-oxo-1H-2-benzopyran-3-yl)methyl]benzamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(1-oxo-1H-2-benzopyran-3-yl)methyl]benzamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(1-oxo-1H-2-benzopyran-3-yl)methyl]benzamide
Compound characteristics
| Compound ID: | Y040-9869 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(1-oxo-1H-2-benzopyran-3-yl)methyl]benzamide |
| Molecular Weight: | 443.5 |
| Molecular Formula: | C27 H25 N O5 |
| Smiles: | COc1ccc(CCNC(c2ccccc2CC2=Cc3ccccc3C(=O)O2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.1143 |
| logD: | 4.1143 |
| logSw: | -4.4231 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.132 |
| InChI Key: | CNBHKYWSWBQETB-UHFFFAOYSA-N |