![2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile structure](/static/products/2411/241127-16-2.webp)
2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile
TL;DR: 2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile (CAS 241127-16-2) is a chemical compound with molecular formula C12H14FN3O2S and molecular weight 283.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butylsulfonyl-N-(2-fluoroanilino)methanimidoyl cyanide
Also Known As: 2-(tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile, 1-tert-butylsulfonyl-N-(2-fluoroanilino)methanimidoyl cyanide, [N-[(2-fluorophenyl)amino]-C-tert-butylsulfonyl-carbonimidoyl]formonitrile
| Molecular Formula | C12H14FN3O2S |
|---|---|
| Molecular Weight | 283.08 g/mol |
| LogP | 2.28798 |
| Topological Polar Surface Area | 82.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 283.07907 |
| Heavy Atoms | 19 |
| Complexity | 639.6737 |
Chemical Identifiers
| CAS Number | 241127-16-2 |
|---|---|
| SMILES | CC(C)(C)S(=O)(=O)C(=NNC1=CC=CC=C1F)C#N |
Product Overview
2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile (CAS 241127-16-2), with molecular formula C12H14FN3O2S and molecular weight 283.08 g/mol. IUPAC: 1-tert-butylsulfonyl-N-(2-fluoroanilino)methanimidoyl cyanide.
Chemical Property Profile of 2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile
Property Insights of 2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile
The XLogP value of 2.28798 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile. The TPSA of 82.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile. Following Lipinski's Rule of Five, 2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile 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-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile?
The CAS number of 2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile is 241127-16-2.
What is the molecular formula of 2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile?
The molecular formula of 2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile is C12H14FN3O2S.
What is the molecular weight of 2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile?
The molecular weight of 2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile is 283.08 g/mol.
Where can I buy 2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile?
You can request a quote for 2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(Tert-butylsulfonyl)-2-[2-(2-fluorophenyl)hydrazono]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.