(4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid
TL;DR: (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid (CAS 708240-64-6) is a chemical compound with molecular formula C14H14N2O3S and molecular weight 290.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(furan-2-ylmethylcarbamothioylamino)phenyl]acetic acid
Also Known As: 2-[4-(2-furylmethylthiocarbamoylamino)phenyl]acetic Acid, 2-(4-(3-(furan-2-ylmethyl)thioureido)phenyl)acetic acid, 2-[4-(furan-2-ylmethylcarbamothioylamino)phenyl]acetic acid, (4-{[(furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid, [4-({[(2-furylmethyl)amino]carbonothioyl}amino)phenyl]acetic acid
| Molecular Formula | C14H14N2O3S |
|---|---|
| Molecular Weight | 290.07 g/mol |
| LogP | 2.3933 |
| Topological Polar Surface Area | 74.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 290.0725 |
| Heavy Atoms | 20 |
| Complexity | 578.9763 |
Chemical Identifiers
| CAS Number | 708240-64-6 |
|---|---|
| SMILES | C1=COC(=C1)CNC(=S)NC2=CC=C(C=C2)CC(=O)O |
Product Overview
(4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid (CAS 708240-64-6), with molecular formula C14H14N2O3S and molecular weight 290.07 g/mol. IUPAC: 2-[4-(furan-2-ylmethylcarbamothioylamino)phenyl]acetic acid.
Chemical Property Profile of (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid
Property Insights of (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid
The XLogP value of 2.3933 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid. The TPSA of 74.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid. Following Lipinski's Rule of Five, (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid has 3 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 (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid?
The CAS number of (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid is 708240-64-6.
What is the molecular formula of (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid?
The molecular formula of (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid is C14H14N2O3S.
What is the molecular weight of (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid?
The molecular weight of (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid is 290.07 g/mol.
Where can I buy (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid?
You can request a quote for (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (4-{[(Furan-2-ylmethyl)carbamothioyl]amino}phenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.