1,1'-Ethylenebis(3-(2-(amidinothio)ethyl)urea) dihydrochloride
2-[2-(2-carbamimidoylsulfanylethylcarbamoylamino)ethylcarbamoylamino]ethyl carbamimidothioate;dihydrochloride
Also Known As: USAF PD-34|KST-1A5460|1,1'-Ethylenebis(3-(2-(amidinothio)ethyl)urea) dihydrochloride|Pseudourea, 2,2'-ethylenebis((2-(ureylene)ethyl)thio)di-, dihydrochloride|Carbamimidothioic acid, 1,2-ethanediylbis(iminocarbonylimino-2,1-ethanediyl) ester, dihydrochloride|Urea, 1,1'-ethylenebis(3-(2-(amidino)thio)ethyl-, dihydrochloride|2-[2-(2-carbamimidoylsulfanylethylcarbamoylamino)ethylcarbam|(14e)-14-amino-14-imino-4,9-dioxo-13-thia-3,5,8,10-tetraazatetradec-1-yl carbamimidothioate dihydrochloride(non-preferred name)|1,12-Bis(isothiuronium)-4,9-dioxo-3,5,8,10-tetraazadodecane dichloride|2-[2-(2-carbamimidoylsulfanylethylcarbamoylamino)ethylcarbamoylamino]ethyl carbamimidothioate dihydrochloride|2-[2-(2-carbamimidoylsulfanylethylcarbamoylamino)ethylcarbamoylamino]ethylcarbamimidothioate,hydrochloride
| Molecular Formula | C10H24Cl2N8O2S2 |
|---|---|
| Molecular Weight | 422.08408 g/mol |
| LogP | -0.31826 |
| Topological Polar Surface Area | 233.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 422.08408 |
| Monoisotopic Mass | 422.08408 |
| Heavy Atoms | 24 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 53389-99-4 |
|---|---|
| SMILES | C(CNC(=O)NCCSC(=N)N)NC(=O)NCCSC(=N)N.Cl.Cl |
| InChIKey | OBHHIECOBQVIES-UHFFFAOYSA-N |
Product Overview
1,1'-Ethylenebis(3-(2-(amidinothio)ethyl)urea) dihydrochloride (CAS 53389-99-4), with molecular formula C10H24Cl2N8O2S2 and molecular weight 422.08408 g/mol. IUPAC: 2-[2-(2-carbamimidoylsulfanylethylcarbamoylamino)ethylcarbamoylamino]ethyl carbamimidothioate;dihydrochloride.