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5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide
TL;DR: 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide (CAS 489452-56-4) is a chemical compound with molecular formula C23H20BrN3O2S and molecular weight 481.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide
Also Known As: 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide, 5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[2-(phenylsulfanyl)phenyl]furan-2-carboxamide, 5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[2-(phenylsulfanyl)phenyl]-2-furamide
| Molecular Formula | C23H20BrN3O2S |
|---|---|
| Molecular Weight | 481.05 g/mol |
| LogP | 6.30724 |
| Topological Polar Surface Area | 60.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 481.04596 |
| Heavy Atoms | 30 |
| Complexity | 1184.3937 |
Chemical Identifiers
| CAS Number | 489452-56-4 |
|---|---|
| SMILES | CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4)C)Br |
Product Overview
5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide (CAS 489452-56-4), with molecular formula C23H20BrN3O2S and molecular weight 481.05 g/mol. IUPAC: 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide.
Chemical Property Profile of 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide
Property Insights of 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide
The XLogP value of 6.30724 indicates that 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide. Following Lipinski's Rule of Five, 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide?
The CAS number of 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide is 489452-56-4.
What is the molecular formula of 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide?
The molecular formula of 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide is C23H20BrN3O2S.
What is the molecular weight of 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide?
The molecular weight of 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide is 481.05 g/mol.
Where can I buy 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide?
You can request a quote for 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.