1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene-
TL;DR: 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene- (CAS 55030-40-5) is a chemical compound with molecular formula C10H14N2O2S2 and molecular weight 258.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N,5-N-diethyl-2-methylidene-1,3-dithiole-4,5-dicarboxamide
Also Known As: 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene-, N,N'-Diethyl-2-methylene-1,3-dithiole-4,5-dicarboxamide, 4-N,5-N-diethyl-2-methylidene-1,3-dithiole-4,5-dicarboxamide, N,N -Diethyl-2-methylene-1,3-dithiole-4,5-dicarboxamide, N4,N5-diethyl-2-methylidene-2H-1,3-dithiole-4,5-dicarboxamide
| Molecular Formula | C10H14N2O2S2 |
|---|---|
| Molecular Weight | 258.05 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 258.04968 |
| Heavy Atoms | 16 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 55030-40-5 |
|---|---|
| SMILES | CCNC(=O)C1=C(SC(=C)S1)C(=O)NCC |
| InChIKey | YLJYQVUDHCYNRY-UHFFFAOYSA-N |
Product Overview
1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene- (CAS 55030-40-5), with molecular formula C10H14N2O2S2 and molecular weight 258.05 g/mol. IUPAC: 4-N,5-N-diethyl-2-methylidene-1,3-dithiole-4,5-dicarboxamide.
Chemical Property Profile of 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene-
Property Insights of 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene-. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene-. Following Lipinski's Rule of Five, 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene- has 2 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 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene-?
The CAS number of 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene- is 55030-40-5.
What is the molecular formula of 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene-?
The molecular formula of 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene- is C10H14N2O2S2.
What is the molecular weight of 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene-?
The molecular weight of 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene- is 258.05 g/mol.
Where can I buy 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene-?
You can request a quote for 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dithiole-4,5-dicarboxamide, N,N'-diethyl-2-methylene- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.