rel-(3R,4S)-3-(4-chlorobenzene-1-sulfonyl)-4-{[2-(4-methoxyphenyl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-(4-chlorobenzene-1-sulfonyl)-4-{[2-(4-methoxyphenyl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-(4-chlorobenzene-1-sulfonyl)-4-{[2-(4-methoxyphenyl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione
Compound characteristics
Compound ID: | D470-2212 |
Compound Name: | rel-(3R,4S)-3-(4-chlorobenzene-1-sulfonyl)-4-{[2-(4-methoxyphenyl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione |
Molecular Weight: | 443.97 |
Molecular Formula: | C19 H22 Cl N O5 S2 |
Smiles: | COc1ccc(CCN[C@H]2CS(C[C@@H]2S(c2ccc(cc2)[Cl])(=O)=O)(=O)=O)cc1 |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 1.6837 |
logD: | 1.6836 |
logSw: | -2.5734 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 77.234 |
InChI Key: | DGGYLQQEGRNWPZ-OALUTQOASA-N |