3-(3,4-dichlorobenzene-1-sulfonyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(3,4-dichlorobenzene-1-sulfonyl)-2H-1-benzopyran-2-one
3-(3,4-dichlorobenzene-1-sulfonyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | C566-0144 |
| Compound Name: | 3-(3,4-dichlorobenzene-1-sulfonyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 355.19 |
| Molecular Formula: | C15 H8 Cl2 O4 S |
| Smiles: | C1=C(C(=O)Oc2ccccc12)S(c1ccc(c(c1)[Cl])[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8824 |
| logD: | 3.8824 |
| logSw: | -4.2338 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.661 |
| InChI Key: | ISTWXQSAGUFILO-UHFFFAOYSA-N |