6-chloro-N-[(3,4-dimethoxyphenyl)methyl]-4-oxo-N-(pyridin-2-yl)-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
6-chloro-N-[(3,4-dimethoxyphenyl)methyl]-4-oxo-N-(pyridin-2-yl)-4H-1-benzopyran-2-carboxamide
6-chloro-N-[(3,4-dimethoxyphenyl)methyl]-4-oxo-N-(pyridin-2-yl)-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D341-1793 |
| Compound Name: | 6-chloro-N-[(3,4-dimethoxyphenyl)methyl]-4-oxo-N-(pyridin-2-yl)-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 450.88 |
| Molecular Formula: | C24 H19 Cl N2 O5 |
| Smiles: | COc1ccc(CN(C(C2=CC(c3cc(ccc3O2)[Cl])=O)=O)c2ccccn2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.541 |
| logD: | 4.541 |
| logSw: | -4.7927 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.18 |
| InChI Key: | GDXRDEKMISWPQU-UHFFFAOYSA-N |