(E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
TL;DR: (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one (CAS 1005560-34-8) is a chemical compound with molecular formula C16H17ClN2O4 and molecular weight 336.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Also Known As: (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one, (2E)-1-(4-chloro-1-methyl-1H-pyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one, (2E)-1-(4-chloro-1-methyl-1H-pyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one, 1-(4-chloro-1-methyl-pyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one, (E)-1-(4-CHLORO-1-METHYL-1H-PYRAZOL-3-YL)-3-(3,4,5-TRIMETHOXYPHENYL)-2-PROPEN-1-ONE
| Molecular Formula | C16H17ClN2O4 |
|---|---|
| Molecular Weight | 336.09 g/mol |
| LogP | 2.9954 |
| Topological Polar Surface Area | 62.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.08768 |
| Heavy Atoms | 23 |
| Complexity | 727.52875 |
Chemical Identifiers
| CAS Number | 1005560-34-8 |
|---|---|
| SMILES | CN1C=C(C(=N1)C(=O)/C=C/C2=CC(=C(C(=C2)OC)OC)OC)Cl |
Product Overview
(E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one (CAS 1005560-34-8), with molecular formula C16H17ClN2O4 and molecular weight 336.09 g/mol. IUPAC: (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one.
Chemical Property Profile of (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Property Insights of (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
The XLogP value of 2.9954 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one. The TPSA of 62.58 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one. Following Lipinski's Rule of Five, (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one has 0 hydrogen bond donor(s) and 5 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 (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one?
The CAS number of (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one is 1005560-34-8.
What is the molecular formula of (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one?
The molecular formula of (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one is C16H17ClN2O4.
What is the molecular weight of (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one?
The molecular weight of (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one is 336.09 g/mol.
Where can I buy (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one?
You can request a quote for (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.