2,4-Dicyano-3-amino-5-methylthiothiophene
TL;DR: 2,4-Dicyano-3-amino-5-methylthiothiophene (CAS 116255-96-0) is a chemical compound with molecular formula C7H5N3S2 and molecular weight 194.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-5-methylsulfanylthiophene-2,4-dicarbonitrile
Also Known As: 2,4-dicyano-3-amino-5-methylthiothiophene, 3-amino-5-methylsulfanylthiophene-2,4-dicarbonitrile, 2-methylthio-3,5-dicyano-4-aminothiophene, 3-Amino-5-methylsulfanyl-thiophene-2,4-dicarbonitrile
| Molecular Formula | C7H5N3S2 |
|---|---|
| Molecular Weight | 194.99 g/mol |
| LogP | 1.79556 |
| Topological Polar Surface Area | 73.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.9925 |
| Heavy Atoms | 12 |
| Complexity | 380.58136 |
Chemical Identifiers
| CAS Number | 116255-96-0 |
|---|---|
| SMILES | CSC1=C(C(=C(S1)C#N)N)C#N |
Product Overview
2,4-Dicyano-3-amino-5-methylthiothiophene (CAS 116255-96-0), with molecular formula C7H5N3S2 and molecular weight 194.99 g/mol. IUPAC: 3-amino-5-methylsulfanylthiophene-2,4-dicarbonitrile.
Chemical Property Profile of 2,4-Dicyano-3-amino-5-methylthiothiophene
Property Insights of 2,4-Dicyano-3-amino-5-methylthiothiophene
The XLogP value of 1.79556 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dicyano-3-amino-5-methylthiothiophene. The TPSA of 73.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dicyano-3-amino-5-methylthiothiophene. Following Lipinski's Rule of Five, 2,4-Dicyano-3-amino-5-methylthiothiophene has 1 hydrogen bond donor(s) and 5 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 2,4-Dicyano-3-amino-5-methylthiothiophene?
The CAS number of 2,4-Dicyano-3-amino-5-methylthiothiophene is 116255-96-0.
What is the molecular formula of 2,4-Dicyano-3-amino-5-methylthiothiophene?
The molecular formula of 2,4-Dicyano-3-amino-5-methylthiothiophene is C7H5N3S2.
What is the molecular weight of 2,4-Dicyano-3-amino-5-methylthiothiophene?
The molecular weight of 2,4-Dicyano-3-amino-5-methylthiothiophene is 194.99 g/mol.
Where can I buy 2,4-Dicyano-3-amino-5-methylthiothiophene?
You can request a quote for 2,4-Dicyano-3-amino-5-methylthiothiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dicyano-3-amino-5-methylthiothiophene?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dicyano-3-amino-5-methylthiothiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.