![[({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid structure](/static/products/6568/656815-91-7.webp)
[({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid
TL;DR: [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid (CAS 656815-91-7) is a chemical compound with molecular formula C17H20N2O3S and molecular weight 332.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(5-methylfuran-2-yl)methyl-[(4-methylphenyl)methyl]carbamothioyl]amino]acetic acid
Also Known As: [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid|7521AE|2-(3-(4-Methylbenzyl)-3-((5-methylfuran-2-yl)methyl)thioureido)acetic acid|3-(4-fluoro-benzylamino)-propionic acid ethyl ester|SR-01000580442-1|2-[[(5-methylfuran-2-yl)methyl-[(4-methylphenyl)methyl]carbamothioyl]amino]acetic acid|({[(5-methylfuran-2-yl)methyl][(4-methylphenyl)methyl]carbamothioyl}amino)acetic acid|2-(3-(4-Methylbenzyl)-3-((5-methylfuran-2-yl)methyl)thioureido)aceticacid|N-({(4-methylbenzyl)[(5-methyl-2-furyl)methyl]amino}carbonothioyl)glycine|2-({[(5-METHYLFURAN-2-YL)METHYL][(4-METHYLPHENYL)METHYL]CARBAMOTHIOYL}AMINO)ACETIC ACID
| Molecular Formula | C17H20N2O3S |
|---|---|
| Molecular Weight | 332.12 g/mol |
| LogP | 2.85774 |
| Topological Polar Surface Area | 65.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 332.11948 |
| Heavy Atoms | 23 |
| Complexity | 679.40186 |
Chemical Identifiers
| CAS Number | 656815-91-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN(CC2=CC=C(O2)C)C(=S)NCC(=O)O |
Product Overview
[({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid (CAS 656815-91-7), with molecular formula C17H20N2O3S and molecular weight 332.12 g/mol. IUPAC: 2-[[(5-methylfuran-2-yl)methyl-[(4-methylphenyl)methyl]carbamothioyl]amino]acetic acid.
Chemical Property Profile of [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid
Property Insights of [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid
The XLogP value of 2.85774 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid. The TPSA of 65.71 Ų falls within the moderate polarity range, balancing permeability and solubility for [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid. Following Lipinski's Rule of Five, [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid 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 [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid?
The CAS number of [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid is 656815-91-7.
What is the molecular formula of [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid?
The molecular formula of [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid is C17H20N2O3S.
What is the molecular weight of [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid?
The molecular weight of [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid is 332.12 g/mol.
Where can I buy [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid?
You can request a quote for [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]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-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [({(4-Methylbenzyl)[(5-methyl-2-furyl)methyl]-amino}carbonothioyl)amino]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.