1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea
TL;DR: 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea (CAS 606102-10-7) is a chemical compound with molecular formula C19H19FN4S and molecular weight 354.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea
Also Known As: ASN 06744236, 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea, Thiourea, N-(2,3-dimethylphenyl)-N-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]- (9CI)
| Molecular Formula | C19H19FN4S |
|---|---|
| Molecular Weight | 354.13 g/mol |
| LogP | 4.94996 |
| Topological Polar Surface Area | 52.74 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 354.13144 |
| Heavy Atoms | 25 |
| Complexity | 915.6736 |
Chemical Identifiers
| CAS Number | 606102-10-7 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)NC(=S)NC2=NNC(=C2C3=CC=C(C=C3)F)C)C |
Product Overview
1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea (CAS 606102-10-7), with molecular formula C19H19FN4S and molecular weight 354.13 g/mol. IUPAC: 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea.
Chemical Property Profile of 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea
Property Insights of 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea
The XLogP value of 4.94996 indicates that 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.74 Ų, 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea has 3 hydrogen bond donor(s) and 2 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-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea?
The CAS number of 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea is 606102-10-7.
What is the molecular formula of 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea?
The molecular formula of 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea is C19H19FN4S.
What is the molecular weight of 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea?
The molecular weight of 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea is 354.13 g/mol.
Where can I buy 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea?
You can request a quote for 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,3-dimethylphenyl)-3-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.