AC1MFJE3
[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl] N-(4-methoxyphenyl)-N'-(2-phenylethyl)carbamimidothioate
Also Known As: [1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl] N-(4-methoxyphenyl)-N'-phenethylcarbamimidothioate|1-(4-methoxyphenyl)-2,5-dioxo-3-pyrrolidinyl N'-(4-methoxyphenyl)-N-(2-phenylethyl)imidothiocarbamate
CAS: 5850-95-3
| Molecular Formula | C27H27N3O4S |
|---|---|
| Molecular Weight | 489.17224 g/mol |
| LogP | 4.7797 |
| Topological Polar Surface Area | 80.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 489.17224 |
| Monoisotopic Mass | 489.17224 |
| Heavy Atoms | 35 |
| Complexity | 1181.313 |
Chemical Identifiers
| CAS Number | 5850-95-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=NCCC2=CC=CC=C2)SC3CC(=O)N(C3=O)C4=CC=C(C=C4)OC |
Product Overview
AC1MFJE3 (CAS 5850-95-3), with molecular formula C27H27N3O4S and molecular weight 489.17224 g/mol. IUPAC: [1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl] N-(4-methoxyphenyl)-N'-(2-phenylethyl)carbamimidothioate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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