![N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide structure](/static/products/6172/61720-77-2.webp)
N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide
TL;DR: N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide (CAS 61720-77-2) is a chemical compound with molecular formula C13H12N2O4S2 and molecular weight 324.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(furan-2-carbothioyl)-3-(4-methylphenyl)sulfonylurea
Also Known As: 1-(furan-2-carbothioyl)-3-(4-methylphenyl)sulfonylurea, 1-(furan-2-carbothioyl)-3-(p-tolylsulfonyl)urea, N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide, 2-Furancarbothioamide, N-[[[(4-methylphenyl)sulfonyl]amino]carbonyl]-
| Molecular Formula | C13H12N2O4S2 |
|---|---|
| Molecular Weight | 324.02 g/mol |
| LogP | 1.95162 |
| Topological Polar Surface Area | 88.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.02383 |
| Heavy Atoms | 21 |
| Complexity | 749.97876 |
Chemical Identifiers
| CAS Number | 61720-77-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC(=S)C2=CC=CO2 |
Product Overview
N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide (CAS 61720-77-2), with molecular formula C13H12N2O4S2 and molecular weight 324.02 g/mol. IUPAC: 1-(furan-2-carbothioyl)-3-(4-methylphenyl)sulfonylurea.
Chemical Property Profile of N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide
Property Insights of N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide
The XLogP value of 1.95162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide. The TPSA of 88.41 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide. Following Lipinski's Rule of Five, N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide has 2 hydrogen bond donor(s) and 5 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 N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide?
The CAS number of N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide is 61720-77-2.
What is the molecular formula of N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide?
The molecular formula of N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide is C13H12N2O4S2.
What is the molecular weight of N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide?
The molecular weight of N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide is 324.02 g/mol.
Where can I buy N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide?
You can request a quote for N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-Methylbenzene-1-sulfonyl)carbamoyl]furan-2-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.