5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide
TL;DR: 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide (CAS 536722-63-1) is a chemical compound with molecular formula C13H10BrN3O3S and molecular weight 366.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-[(2-carbamoylphenyl)carbamothioyl]furan-2-carboxamide
Also Known As: o-[3-(5-bromo-2-furoyl)thioureido]benzamide, 5-bromo-N-[(2-carbamoylphenyl)carbamothioyl]furan-2-carboxamide, 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide, 5-bromo-N-((2-carbamoylphenyl)carbamothioyl)furan-2-carboxamide, 2-({[(5-BROMOFURAN-2-YL)FORMAMIDO]METHANETHIOYL}AMINO)BENZAMIDE
| Molecular Formula | C13H10BrN3O3S |
|---|---|
| Molecular Weight | 366.96 g/mol |
| LogP | 2.2678 |
| Topological Polar Surface Area | 97.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 366.96262 |
| Heavy Atoms | 21 |
| Complexity | 714.19196 |
Chemical Identifiers
| CAS Number | 536722-63-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)N)NC(=S)NC(=O)C2=CC=C(O2)Br |
Product Overview
5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide (CAS 536722-63-1), with molecular formula C13H10BrN3O3S and molecular weight 366.96 g/mol. IUPAC: 5-bromo-N-[(2-carbamoylphenyl)carbamothioyl]furan-2-carboxamide.
Chemical Property Profile of 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide
Property Insights of 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide
The XLogP value of 2.2678 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide. The TPSA of 97.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide. Following Lipinski's Rule of Five, 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide has 3 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 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide?
The CAS number of 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide is 536722-63-1.
What is the molecular formula of 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide?
The molecular formula of 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide is C13H10BrN3O3S.
What is the molecular weight of 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide?
The molecular weight of 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide is 366.96 g/mol.
Where can I buy 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide?
You can request a quote for 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-furancarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.