ethyl S-[1-(4-iodophenyl)-2,5-dioxopyrrolidin-3-yl]cysteinate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl S-[1-(4-iodophenyl)-2,5-dioxopyrrolidin-3-yl]cysteinate--hydrogen chloride (1/1)
ethyl S-[1-(4-iodophenyl)-2,5-dioxopyrrolidin-3-yl]cysteinate--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | 4514-1445 |
Compound Name: | ethyl S-[1-(4-iodophenyl)-2,5-dioxopyrrolidin-3-yl]cysteinate--hydrogen chloride (1/1) |
Molecular Weight: | 484.74 |
Molecular Formula: | C15 H17 I N2 O4 S |
Salt: | HCl |
Smiles: | CCOC(C(CSC1CC(N(C1=O)c1ccc(cc1)I)=O)N)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 1.0436 |
logD: | 1.0151 |
logSw: | -2.2717 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 70.972 |
InChI Key: | NXQCKDNMDMGVKK-UHFFFAOYSA-N |