![2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide structure](/static/products/468/468102-50-3.png)
2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide
TL;DR: 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide (CAS 468102-50-3) is a chemical compound with molecular formula C15H19N5O2S2 and molecular weight 365.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1Z)-2-amino-N-[4-(azepan-1-ylsulfonyl)anilino]-2-sulfanylideneethanimidoyl cyanide
Also Known As: 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide, (1Z)-2-amino-N-[4-(azepan-1-ylsulfonyl)anilino]-2-sulfanylideneethanimidoyl cyanide
| Molecular Formula | C15H19N5O2S2 |
|---|---|
| Molecular Weight | 365.10 g/mol |
| LogP | 1.82888 |
| Topological Polar Surface Area | 111.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 365.09802 |
| Heavy Atoms | 24 |
| Complexity | 758.0493 |
Chemical Identifiers
| CAS Number | 468102-50-3 |
|---|---|
| SMILES | C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N/N=C(/C#N)\C(=S)N |
Product Overview
2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide (CAS 468102-50-3), with molecular formula C15H19N5O2S2 and molecular weight 365.10 g/mol. IUPAC: (1Z)-2-amino-N-[4-(azepan-1-ylsulfonyl)anilino]-2-sulfanylideneethanimidoyl cyanide.
Chemical Property Profile of 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide
Property Insights of 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide
The XLogP value of 1.82888 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide. The TPSA of 111.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide. Following Lipinski's Rule of Five, 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide has 2 hydrogen bond donor(s) and 6 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-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide?
The CAS number of 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide is 468102-50-3.
What is the molecular formula of 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide?
The molecular formula of 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide is C15H19N5O2S2.
What is the molecular weight of 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide?
The molecular weight of 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide is 365.10 g/mol.
Where can I buy 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide?
You can request a quote for 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-{[4-(1-azepanylsulfonyl)phenyl]hydrazono}-2-cyanoethanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.