N-[(3,4-dichlorophenyl)methyl]-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-(3,4,5-trimethoxyphenyl)propanamide
Chemical Structure Depiction of
N-[(3,4-dichlorophenyl)methyl]-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-(3,4,5-trimethoxyphenyl)propanamide
N-[(3,4-dichlorophenyl)methyl]-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-(3,4,5-trimethoxyphenyl)propanamide
Compound characteristics
| Compound ID: | 8020-8476 |
| Compound Name: | N-[(3,4-dichlorophenyl)methyl]-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-(3,4,5-trimethoxyphenyl)propanamide |
| Molecular Weight: | 558.41 |
| Molecular Formula: | C28 H25 Cl2 N O7 |
| Smiles: | COc1cc(cc(c1OC)OC)C(CC(NCc1ccc(c(c1)[Cl])[Cl])=O)C1=C(c2ccccc2OC1=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4455 |
| logD: | 1.9265 |
| logSw: | -4.3871 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.137 |
| InChI Key: | HJXATTOPQCRMEL-SFHVURJKSA-N |