![Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate structure](/static/products/7082/708283-21-0.webp)
Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate
TL;DR: Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate (CAS 708283-21-0) is a chemical compound with molecular formula C14H18N2O3S and molecular weight 294.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(oxolan-2-ylmethylcarbamothioylamino)benzoate
Also Known As: AB00029365-01, methyl 4-(oxolan-2-ylmethylcarbamothioylamino)benzoate, methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate, methyl 4-(3-((tetrahydrofuran-2-yl)methyl)thioureido)benzoate
| Molecular Formula | C14H18N2O3S |
|---|---|
| Molecular Weight | 294.10 g/mol |
| LogP | 1.9386 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.10382 |
| Heavy Atoms | 20 |
| Complexity | 469.8123 |
Chemical Identifiers
| CAS Number | 708283-21-0 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)NC(=S)NCC2CCCO2 |
Product Overview
Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate (CAS 708283-21-0), with molecular formula C14H18N2O3S and molecular weight 294.10 g/mol. IUPAC: methyl 4-(oxolan-2-ylmethylcarbamothioylamino)benzoate.
Chemical Property Profile of Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate
Property Insights of Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate
The XLogP value of 1.9386 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate. With a topological polar surface area (TPSA) of 59.59 Ų, Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate 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}benzoate?
The CAS number of Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate is 708283-21-0.
What is the molecular formula of Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate?
The molecular formula of Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate is C14H18N2O3S.
What is the molecular weight of Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate?
The molecular weight of Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate is 294.10 g/mol.
Where can I buy Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate?
You can request a quote for Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate 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}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.