![3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate structure](/static/products/3182/318237-85-3.webp)
3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate
TL;DR: 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate (CAS 318237-85-3) is a chemical compound with molecular formula C23H21F3N2O3 and molecular weight 430.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-(4-methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate
Also Known As: 3M-703, 3-[1-(4-methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate, 3-(1-(4-Methylbenzoyl)-3-(trifluoromethyl)-1H-pyrazol-4-yl)propyl 4-methylbenzenecarboxylate, 3-[1-(4-methylbenzoyl)-3-(trifluoromethyl)-1H-pyrazol-4-yl]propyl 4-methylbenzoate, 3-[1-(4-methylbenzoyl)-3-(trifluoromethyl)-1H-pyrazol-4-yl]propyl 4-methylbenzenecarboxylate
| Molecular Formula | C23H21F3N2O3 |
|---|---|
| Molecular Weight | 430.15 g/mol |
| LogP | 4.99684 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 430.15042 |
| Heavy Atoms | 31 |
| Complexity | 1068.9413 |
Chemical Identifiers
| CAS Number | 318237-85-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)N2C=C(C(=N2)C(F)(F)F)CCCOC(=O)C3=CC=C(C=C3)C |
Product Overview
3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate (CAS 318237-85-3), with molecular formula C23H21F3N2O3 and molecular weight 430.15 g/mol. IUPAC: 3-[1-(4-methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate.
Chemical Property Profile of 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate
Property Insights of 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate
The XLogP value of 4.99684 indicates that 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate. Following Lipinski's Rule of Five, 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate has 0 hydrogen bond donor(s) and 4 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 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate?
The CAS number of 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate is 318237-85-3.
What is the molecular formula of 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate?
The molecular formula of 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate is C23H21F3N2O3.
What is the molecular weight of 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate?
The molecular weight of 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate is 430.15 g/mol.
Where can I buy 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate?
You can request a quote for 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for 3-[1-(4-Methylbenzoyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.