3-(4-methylbenzene-1-sulfonyl)-N-(4-methylphenyl)-2-oxo-2H-1-benzopyran-6-carboxamide
Chemical Structure Depiction of
3-(4-methylbenzene-1-sulfonyl)-N-(4-methylphenyl)-2-oxo-2H-1-benzopyran-6-carboxamide
3-(4-methylbenzene-1-sulfonyl)-N-(4-methylphenyl)-2-oxo-2H-1-benzopyran-6-carboxamide
Compound characteristics
| Compound ID: | C566-0627 |
| Compound Name: | 3-(4-methylbenzene-1-sulfonyl)-N-(4-methylphenyl)-2-oxo-2H-1-benzopyran-6-carboxamide |
| Molecular Weight: | 433.48 |
| Molecular Formula: | C24 H19 N O5 S |
| Smiles: | Cc1ccc(cc1)NC(c1ccc2c(C=C(C(=O)O2)S(c2ccc(C)cc2)(=O)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6869 |
| logD: | 4.6868 |
| logSw: | -4.56 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.752 |
| InChI Key: | XUKOCKHOLZNNCC-UHFFFAOYSA-N |