![2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide structure](/static/products/3290/329078-75-3.webp)
2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide
TL;DR: 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide (CAS 329078-75-3) is a chemical compound with molecular formula C14H14N2O2S and molecular weight 274.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(furan-2-ylmethylamino)-N-(4-methylphenyl)-2-sulfanylideneacetamide
Also Known As: 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide, 2-(furan-2-ylmethylamino)-N-(4-methylphenyl)-2-sulfanylideneacetamide, AA-768/30961020, 1-{[(furan-2-yl)methyl]carbamothioyl}-N-(4-methylphenyl)formamide
| Molecular Formula | C14H14N2O2S |
|---|---|
| Molecular Weight | 274.08 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 86.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.0776 |
| Heavy Atoms | 19 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 329078-75-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)C(=S)NCC2=CC=CO2 |
| InChIKey | JSMSFLZIQUECEV-UHFFFAOYSA-N |
Product Overview
2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide (CAS 329078-75-3), with molecular formula C14H14N2O2S and molecular weight 274.08 g/mol. IUPAC: 2-(furan-2-ylmethylamino)-N-(4-methylphenyl)-2-sulfanylideneacetamide.
Chemical Property Profile of 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide
Property Insights of 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide. The TPSA of 86.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide. Following Lipinski's Rule of Five, 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide has 2 hydrogen bond donor(s) and 3 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-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide?
The CAS number of 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide is 329078-75-3.
What is the molecular formula of 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide?
The molecular formula of 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide is C14H14N2O2S.
What is the molecular weight of 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide?
The molecular weight of 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide is 274.08 g/mol.
Where can I buy 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide?
You can request a quote for 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-furylmethyl)amino]-N-(4-methylphenyl)-2-thioxoacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.