3-(4-chlorobenzene-1-sulfonyl)-N-(3,4-dimethoxyphenyl)-2-oxo-2H-1-benzopyran-6-carboxamide
Chemical Structure Depiction of
3-(4-chlorobenzene-1-sulfonyl)-N-(3,4-dimethoxyphenyl)-2-oxo-2H-1-benzopyran-6-carboxamide
3-(4-chlorobenzene-1-sulfonyl)-N-(3,4-dimethoxyphenyl)-2-oxo-2H-1-benzopyran-6-carboxamide
Compound characteristics
| Compound ID: | C566-0468 |
| Compound Name: | 3-(4-chlorobenzene-1-sulfonyl)-N-(3,4-dimethoxyphenyl)-2-oxo-2H-1-benzopyran-6-carboxamide |
| Molecular Weight: | 499.93 |
| Molecular Formula: | C24 H18 Cl N O7 S |
| Smiles: | COc1ccc(cc1OC)NC(c1ccc2c(C=C(C(=O)O2)S(c2ccc(cc2)[Cl])(=O)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9697 |
| logD: | 3.9682 |
| logSw: | -4.5438 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.013 |
| InChI Key: | ZXYYPOPUCPPQIU-UHFFFAOYSA-N |