![Bis[4-amino-3-cyanophenyl]sulfide structure](/static/products/6138/61382-02-3.webp)
Bis[4-amino-3-cyanophenyl]sulfide
TL;DR: Bis[4-amino-3-cyanophenyl]sulfide (CAS 61382-02-3) is a chemical compound with molecular formula C14H10N4S and molecular weight 266.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-5-(4-amino-3-cyanophenyl)sulfanylbenzonitrile
Also Known As: Bis[4-amino-3-cyanophenyl]sulfide, Benzonitrile, 3,3'-thiobis[6-amino-, 2-amino-5-(4-amino-3-cyanophenyl)sulfanylbenzonitrile, 3,3'-Sulfanediylbis(6-aminobenzonitrile), NCI60_034098
| Molecular Formula | C14H10N4S |
|---|---|
| Molecular Weight | 266.06 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.06262 |
| Heavy Atoms | 19 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 61382-02-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1SC2=CC(=C(C=C2)N)C#N)C#N)N |
| InChIKey | HSUYVLRLGOKVNJ-UHFFFAOYSA-N |
Product Overview
Bis[4-amino-3-cyanophenyl]sulfide (CAS 61382-02-3), with molecular formula C14H10N4S and molecular weight 266.06 g/mol. IUPAC: 2-amino-5-(4-amino-3-cyanophenyl)sulfanylbenzonitrile.
Chemical Property Profile of Bis[4-amino-3-cyanophenyl]sulfide
Property Insights of Bis[4-amino-3-cyanophenyl]sulfide
The XLogP value of 3.2 indicates that Bis[4-amino-3-cyanophenyl]sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis[4-amino-3-cyanophenyl]sulfide. Following Lipinski's Rule of Five, Bis[4-amino-3-cyanophenyl]sulfide has 2 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 Bis[4-amino-3-cyanophenyl]sulfide?
The CAS number of Bis[4-amino-3-cyanophenyl]sulfide is 61382-02-3.
What is the molecular formula of Bis[4-amino-3-cyanophenyl]sulfide?
The molecular formula of Bis[4-amino-3-cyanophenyl]sulfide is C14H10N4S.
What is the molecular weight of Bis[4-amino-3-cyanophenyl]sulfide?
The molecular weight of Bis[4-amino-3-cyanophenyl]sulfide is 266.06 g/mol.
Where can I buy Bis[4-amino-3-cyanophenyl]sulfide?
You can request a quote for Bis[4-amino-3-cyanophenyl]sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis[4-amino-3-cyanophenyl]sulfide?
Yes, KEHONG BIO provides custom synthesis services for Bis[4-amino-3-cyanophenyl]sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.