(E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate
TL;DR: (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate (CAS 1164461-98-6) is a chemical compound with molecular formula C28H26N2O5 and molecular weight 470.18417 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[3-(3,4-dimethoxyphenyl)-2-[(E)-3-phenylprop-2-enoyl]-3,4-dihydropyrazol-5-yl]phenyl] acetate
Also Known As: (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate, [2-[3-(3,4-dimethoxyphenyl)-2-[(E)-3-phenylprop-2-enoyl]-3,4-dihydropyrazol-5-yl]phenyl] acetate, 2-{5-(3,4-dimethoxyphenyl)-1-[(2E)-3-phenylprop-2-enoyl]-4,5-dihydro-1H-pyrazol-3-yl}phenyl acetate, Acetic acid 2-{5-(3,4-dimethoxy-phenyl)-1-[(E)-(3-phenyl-acryloyl)]-4,5-dihydro-1H-pyrazol-3-yl}-phenyl ester
Technical Specifications
| Molecular Formula | C28H26N2O5 |
| Molecular Weight | 470.18417 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 77.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 470.18417 Da |
| Heavy Atoms | 35 |
| Complexity | 790.0 |
| SMILES | CC(=O)OC1=CC=CC=C1C2=NN(C(C2)C3=CC(=C(C=C3)OC)OC)C(=O)/C=C/C4=CC=CC=C4 |
| InChIKey | QVPOSFBYDCCCMR-DTQAZKPQSA-N |
Chemical Property Profile of (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate
Property Insights of (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate
The XLogP value of 4.5 indicates that (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate. Following Lipinski's Rule of Five, (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate?
The CAS number of (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate is 1164461-98-6.
What is the molecular formula of (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate?
The molecular formula of (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate is C28H26N2O5.
What is the molecular weight of (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate?
The molecular weight of (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate is 470.18417 g/mol.
Where can I buy (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate?
You can request a quote for (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate?
Yes, CoreyChem provides custom synthesis services for (E)-2-(1-cinnamoyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.