![4-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide structure](/static/products/4942/494218-89-2.webp)
4-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide
TL;DR: 4-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide (CAS 494218-89-2) is a chemical compound with molecular formula C13H12ClIN4OS and molecular weight 433.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[(2-iodophenyl)carbamothioyl]-1,3-dimethylpyrazole-5-carboxamide
Also Known As: 4-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide, N-[(4-CHLORO-1,3-DIMETHYL-1H-PYRAZOL-5-YL)CARBONYL]-N'-(2-IODOPHENYL)THIOUREA, 4-chloro-N-[(2-iodophenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide, 4-chloro-N-[(2-iodophenyl)thiocarbamoyl]-2,5-dimethyl-pyrazole-3-carboxamide
| Molecular Formula | C13H12ClIN4OS |
|---|---|
| Molecular Weight | 433.95 g/mol |
| LogP | 3.11332 |
| Topological Polar Surface Area | 58.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 433.9465 |
| Heavy Atoms | 21 |
| Complexity | 716.19196 |
Chemical Identifiers
| CAS Number | 494218-89-2 |
|---|---|
| SMILES | CC1=NN(C(=C1Cl)C(=O)NC(=S)NC2=CC=CC=C2I)C |
Product Overview
4-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide (CAS 494218-89-2), with molecular formula C13H12ClIN4OS and molecular weight 433.95 g/mol. IUPAC: 4-chloro-N-[(2-iodophenyl)carbamothioyl]-1,3-dimethylpyrazole-5-carboxamide.
Chemical Property Profile of 4-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide
Property Insights of 4-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide
The XLogP value of 3.11332 indicates that 4-chloro-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-chloro-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-chloro-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-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide?
The CAS number of 4-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide is 494218-89-2.
What is the molecular formula of 4-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide?
The molecular formula of 4-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide is C13H12ClIN4OS.
What is the molecular weight of 4-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide?
The molecular weight of 4-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide is 433.95 g/mol.
Where can I buy 4-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide?
You can request a quote for 4-chloro-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-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-[(2-iodophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.