![4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide structure](/static/products/4942/494219-86-2.webp)
4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide
TL;DR: 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide (CAS 494219-86-2) is a chemical compound with molecular formula C13H12BrIN4OS and molecular weight 477.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[(2-iodophenyl)carbamothioyl]-1,3-dimethylpyrazole-5-carboxamide
Also Known As: 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide, 4-bromo-N-[(2-iodophenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide, N-[(4-bromo-1,3-dimethyl-1H-pyrazol-5-yl)carbonyl]-N'-(2-iodophenyl)thiourea
| Molecular Formula | C13H12BrIN4OS |
|---|---|
| Molecular Weight | 477.90 g/mol |
| LogP | 3.22242 |
| Topological Polar Surface Area | 58.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 477.896 |
| Heavy Atoms | 21 |
| Complexity | 716.19196 |
Chemical Identifiers
| CAS Number | 494219-86-2 |
|---|---|
| SMILES | CC1=NN(C(=C1Br)C(=O)NC(=S)NC2=CC=CC=C2I)C |
Product Overview
4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide (CAS 494219-86-2), with molecular formula C13H12BrIN4OS and molecular weight 477.90 g/mol. IUPAC: 4-bromo-N-[(2-iodophenyl)carbamothioyl]-1,3-dimethylpyrazole-5-carboxamide.
Chemical Property Profile of 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide
Property Insights of 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide
The XLogP value of 3.22242 indicates that 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.95 Ų, 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide has 2 hydrogen bond donor(s) and 3 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 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide?
The CAS number of 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide is 494219-86-2.
What is the molecular formula of 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide?
The molecular formula of 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide is C13H12BrIN4OS.
What is the molecular weight of 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide?
The molecular weight of 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide is 477.90 g/mol.
Where can I buy 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide?
You can request a quote for 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.