ethyl S-[1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]cysteinate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl S-[1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]cysteinate--hydrogen chloride (1/1)
ethyl S-[1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]cysteinate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8009-6726 |
| Compound Name: | ethyl S-[1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]cysteinate--hydrogen chloride (1/1) |
| Molecular Weight: | 393.29 |
| Molecular Formula: | C15 H17 Cl N2 O4 S |
| Salt: | HCl |
| Smiles: | CCOC(C(CSC1CC(N(C1=O)c1cccc(c1)[Cl])=O)N)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.4725 |
| logD: | 0.444 |
| logSw: | -2.4068 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.972 |
| InChI Key: | GCTWDCWOQMXUTP-UHFFFAOYSA-N |