N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine
TL;DR: N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine (CAS 93114-08-0) is a chemical compound with molecular formula C8H18N2O2S and molecular weight 206.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine
Also Known As: (S)-1-methyl-3-phenylpiperazine, BAS 01426088, N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine, AF-399/13804002, 1,2-ethanediamine, N,N-dimethyl-N'-(tetrahydro-1,1-dioxido-3-thienyl)-, dihydrochloride
| Molecular Formula | C8H18N2O2S |
|---|---|
| Molecular Weight | 206.11 g/mol |
| LogP | -0.6753 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.1089 |
| Heavy Atoms | 13 |
| Complexity | 248.86964 |
Chemical Identifiers
| CAS Number | 93114-08-0 |
|---|---|
| SMILES | CN(C)CCNC1CCS(=O)(=O)C1 |
Product Overview
N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine (CAS 93114-08-0), with molecular formula C8H18N2O2S and molecular weight 206.11 g/mol. IUPAC: N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine.
Chemical Property Profile of N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine
Property Insights of N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine
The XLogP value of -0.6753 indicates that N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.41 Ų, N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine?
The CAS number of N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine is 93114-08-0.
What is the molecular formula of N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine?
The molecular formula of N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine is C8H18N2O2S.
What is the molecular weight of N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine?
The molecular weight of N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine is 206.11 g/mol.
Where can I buy N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine?
You can request a quote for N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine?
Yes, KEHONG BIO provides custom synthesis services for N-(1,1-dioxothiolan-3-yl)-N',N'-dimethylethane-1,2-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.