(E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate
TL;DR: (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate (CAS 1164542-91-9) is a chemical compound with molecular formula C27H24N2O4 and molecular weight 440.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[3-(4-methoxyphenyl)-2-[(E)-3-phenylprop-2-enoyl]-3,4-dihydropyrazol-5-yl]phenyl] acetate
Also Known As: (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate, [2-[3-(4-methoxyphenyl)-2-[(E)-3-phenylprop-2-enoyl]-3,4-dihydropyrazol-5-yl]phenyl] acetate, 2-{5-(4-methoxyphenyl)-1-[(2E)-3-phenylprop-2-enoyl]-4,5-dihydro-1H-pyrazol-3-yl}phenyl acetate, Acetic acid 2-{5-(4-methoxy-phenyl)-1-[(E)-(3-phenyl-acryloyl)]-4,5-dihydro-1H-pyrazol-3-yl}-phenyl ester
| Molecular Formula | C27H24N2O4 |
|---|---|
| Molecular Weight | 440.17 g/mol |
| LogP | 5.0116 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 440.1736 |
| Heavy Atoms | 33 |
| Complexity | 1200.3057 |
Chemical Identifiers
| CAS Number | 1164542-91-9 |
|---|---|
| SMILES | CC(=O)OC1=CC=CC=C1C2=NN(C(C2)C3=CC=C(C=C3)OC)C(=O)/C=C/C4=CC=CC=C4 |
Product Overview
(E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate (CAS 1164542-91-9), with molecular formula C27H24N2O4 and molecular weight 440.17 g/mol. IUPAC: [2-[3-(4-methoxyphenyl)-2-[(E)-3-phenylprop-2-enoyl]-3,4-dihydropyrazol-5-yl]phenyl] acetate.
Chemical Property Profile of (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate
Property Insights of (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate
The XLogP value of 5.0116 indicates that (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-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 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate. Following Lipinski's Rule of Five, (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate?
The CAS number of (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate is 1164542-91-9.
What is the molecular formula of (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate?
The molecular formula of (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate is C27H24N2O4.
What is the molecular weight of (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate?
The molecular weight of (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate is 440.17 g/mol.
Where can I buy (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate?
You can request a quote for (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(1-cinnamoyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.