N-[6-chloro-3-(4-chlorophenyl)-4-oxo-4H-1-benzopyran-2-yl]-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-[6-chloro-3-(4-chlorophenyl)-4-oxo-4H-1-benzopyran-2-yl]-3,4-dimethoxybenzamide
N-[6-chloro-3-(4-chlorophenyl)-4-oxo-4H-1-benzopyran-2-yl]-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | IB08-1284 |
| Compound Name: | N-[6-chloro-3-(4-chlorophenyl)-4-oxo-4H-1-benzopyran-2-yl]-3,4-dimethoxybenzamide |
| Molecular Weight: | 470.31 |
| Molecular Formula: | C24 H17 Cl2 N O5 |
| Smiles: | COc1ccc(cc1OC)C(NC1=C(C(c2cc(ccc2O1)[Cl])=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.98 |
| logD: | 4.94 |
| logSw: | -6.02 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 108.59 |
| InChI Key: | RDHSPUNLZMEHBI-UHFFFAOYSA-N |