1-[3-(3,4-dichlorobenzene-1-sulfonyl)benzene-1-sulfonyl]azepane
Chemical Structure Depiction of
1-[3-(3,4-dichlorobenzene-1-sulfonyl)benzene-1-sulfonyl]azepane
1-[3-(3,4-dichlorobenzene-1-sulfonyl)benzene-1-sulfonyl]azepane
Compound characteristics
| Compound ID: | 8012-8377 |
| Compound Name: | 1-[3-(3,4-dichlorobenzene-1-sulfonyl)benzene-1-sulfonyl]azepane |
| Molecular Weight: | 448.39 |
| Molecular Formula: | C18 H19 Cl2 N O4 S2 |
| Smiles: | C1CCCN(CC1)S(c1cccc(c1)S(c1ccc(c(c1)[Cl])[Cl])(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8066 |
| logD: | 4.8066 |
| logSw: | -4.9201 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.781 |
| InChI Key: | OYDSDAWGCQHNSR-UHFFFAOYSA-N |