![({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate structure](/static/products/6728/6728-17-2.webp)
({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate
TL;DR: ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate (CAS 6728-17-2) is a chemical compound with molecular formula C16H17N2O3S- and molecular weight 317.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[furan-2-ylmethyl-[(4-methylphenyl)methyl]carbamothioyl]amino]acetate
Also Known As: ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate, 2-[[furan-2-ylmethyl-[(4-methylphenyl)methyl]carbamothioyl]amino]acetate
| Molecular Formula | C16H17N2O3S- |
|---|---|
| Molecular Weight | 317.10 g/mol |
| LogP | 1.21462 |
| Topological Polar Surface Area | 68.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 317.09598 |
| Heavy Atoms | 22 |
| Complexity | 623.3503 |
Chemical Identifiers
| CAS Number | 6728-17-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN(CC2=CC=CO2)C(=S)NCC(=O)[O-] |
Product Overview
({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate (CAS 6728-17-2), with molecular formula C16H17N2O3S- and molecular weight 317.10 g/mol. IUPAC: 2-[[furan-2-ylmethyl-[(4-methylphenyl)methyl]carbamothioyl]amino]acetate.
Chemical Property Profile of ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate
Property Insights of ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate
The XLogP value of 1.21462 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate. The TPSA of 68.54 Ų falls within the moderate polarity range, balancing permeability and solubility for ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate. Following Lipinski's Rule of Five, ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate has 1 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 ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate?
The CAS number of ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate is 6728-17-2.
What is the molecular formula of ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate?
The molecular formula of ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate is C16H17N2O3S-.
What is the molecular weight of ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate?
The molecular weight of ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate is 317.10 g/mol.
Where can I buy ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate?
You can request a quote for ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate?
Yes, KEHONG BIO provides custom synthesis services for ({[(Furan-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.