2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide
TL;DR: 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide (CAS 112853-36-8) is a chemical compound with molecular formula C10H10N4S and molecular weight 218.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide
Also Known As: 2-cyano-2-(p-tolylhydrazono)thioacetamide, 2-cyano-2-[(4-methylphenyl)hydrazono]ethanethioamide, 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide, (Z)-1-CARBAMOTHIOYL-N-(4-METHYLPHENYL)METHANECARBOHYDRAZONOYL CYANIDE
| Molecular Formula | C10H10N4S |
|---|---|
| Molecular Weight | 218.06 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.06262 |
| Heavy Atoms | 15 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 112853-36-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NN=C(C#N)C(=S)N |
| InChIKey | RPVOSBBQXAMJEF-UHFFFAOYSA-N |
Product Overview
2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide (CAS 112853-36-8), with molecular formula C10H10N4S and molecular weight 218.06 g/mol. IUPAC: 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide.
Chemical Property Profile of 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide
Property Insights of 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide. Following Lipinski's Rule of Five, 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide 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 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide?
The CAS number of 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide is 112853-36-8.
What is the molecular formula of 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide?
The molecular formula of 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide is C10H10N4S.
What is the molecular weight of 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide?
The molecular weight of 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide is 218.06 g/mol.
Where can I buy 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide?
You can request a quote for 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-N-(4-methylanilino)-2-sulfanylideneethanimidoyl cyanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.