![Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate structure](/static/products/5164/516457-35-5.webp)
Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate
TL;DR: Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate (CAS 516457-35-5) is a chemical compound with molecular formula C15H20N2O3S and molecular weight 308.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-(oxolan-2-ylmethylcarbamothioylamino)phenyl]acetate
Also Known As: methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate, methyl 2-[4-(oxolan-2-ylmethylcarbamothioylamino)phenyl]acetate, methyl 2-(4-(3-((tetrahydrofuran-2-yl)methyl)thioureido)phenyl)acetate, methyl 2-[4-({[(oxolan-2-ylmethyl)amino]thioxomethyl}amino)phenyl]acetate, METHYL 2-[4-({[(TETRAHYDRO-2-FURANYLMETHYL)AMINO]CARBOTHIOYL}AMINO)PHENYL]ACETATE
| Molecular Formula | C15H20N2O3S |
|---|---|
| Molecular Weight | 308.12 g/mol |
| LogP | 1.8675 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.11948 |
| Heavy Atoms | 21 |
| Complexity | 484.19702 |
Chemical Identifiers
| CAS Number | 516457-35-5 |
|---|---|
| SMILES | COC(=O)CC1=CC=C(C=C1)NC(=S)NCC2CCCO2 |
Product Overview
Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate (CAS 516457-35-5), with molecular formula C15H20N2O3S and molecular weight 308.12 g/mol. IUPAC: methyl 2-[4-(oxolan-2-ylmethylcarbamothioylamino)phenyl]acetate.
Chemical Property Profile of Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate
Property Insights of Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate
The XLogP value of 1.8675 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate. With a topological polar surface area (TPSA) of 59.59 Ų, Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate 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 Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate?
The CAS number of Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate is 516457-35-5.
What is the molecular formula of Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate?
The molecular formula of Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate is C15H20N2O3S.
What is the molecular weight of Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate?
The molecular weight of Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate is 308.12 g/mol.
Where can I buy Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate?
You can request a quote for Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl (4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}phenyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.