![1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea structure](/static/products/104/1044538-32-0.png)
1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea
TL;DR: 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea (CAS 1044538-32-0) is a chemical compound with molecular formula C18H15ClFN5OS and molecular weight 403.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea
Also Known As: 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea, N-({[(3-chloro-4-fluorophenyl)amino]thioxomethyl}amino)[5-(4-methylphenyl)pyra zol-3-yl]carboxamide, N-(3-chloro-4-fluorophenyl)-2-{[5-(4-methylphenyl)-1H-pyrazol-3-yl]carbonyl}hydrazinecarbothioamide, N~1~-(3-CHLORO-4-FLUOROPHENYL)-2-{[5-(4-METHYLPHENYL)-1H-PYRAZOL-3-YL]CARBONYL}-1-HYDRAZINECARBOTHIOAMIDE
| Molecular Formula | C18H15ClFN5OS |
|---|---|
| Molecular Weight | 403.07 g/mol |
| LogP | 3.80902 |
| Topological Polar Surface Area | 81.84 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 403.067 |
| Heavy Atoms | 27 |
| Complexity | 989.672 |
Chemical Identifiers
| CAS Number | 1044538-32-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NNC(=S)NC3=CC(=C(C=C3)F)Cl |
Product Overview
1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea (CAS 1044538-32-0), with molecular formula C18H15ClFN5OS and molecular weight 403.07 g/mol. IUPAC: 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea.
Chemical Property Profile of 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea
Property Insights of 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea
The XLogP value of 3.80902 indicates that 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea. Following Lipinski's Rule of Five, 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea has 4 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 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea?
The CAS number of 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea is 1044538-32-0.
What is the molecular formula of 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea?
The molecular formula of 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea is C18H15ClFN5OS.
What is the molecular weight of 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea?
The molecular weight of 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea is 403.07 g/mol.
Where can I buy 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea?
You can request a quote for 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-chloro-4-fluorophenyl)-3-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.