1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone
TL;DR: 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone (CAS 708221-61-8) is a chemical compound with molecular formula C19H19ClN2O4 and molecular weight 374.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-(5-chloro-2-hydroxyphenyl)-3-(3,4-dimethoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone
Also Known As: 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone, (6E)-6-[1-acetyl-5-(3,4-dimethoxyphenyl)pyrazolidin-3-ylidene]-4-chlorocyclohexa-2,4-dien-1-one, (6Z)-6-[1-acetyl-5-(3,4-dimethoxyphenyl)pyrazolidin-3-ylidene]-4-chlorocyclohexa-2,4-dien-1-one, 1-[3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone, 6-[1-acetyl-5-(3,4-dimethoxyphenyl)pyrazolidin-3-ylidene]-4-chlorocyclohexa-2,4-dien-1-one
| Molecular Formula | C19H19ClN2O4 |
|---|---|
| Molecular Weight | 374.10 g/mol |
| LogP | 3.7604 |
| Topological Polar Surface Area | 71.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 374.10333 |
| Heavy Atoms | 26 |
| Complexity | 881.838 |
Chemical Identifiers
| CAS Number | 708221-61-8 |
|---|---|
| SMILES | CC(=O)N1C(CC(=N1)C2=C(C=CC(=C2)Cl)O)C3=CC(=C(C=C3)OC)OC |
Product Overview
1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone (CAS 708221-61-8), with molecular formula C19H19ClN2O4 and molecular weight 374.10 g/mol. IUPAC: 1-[5-(5-chloro-2-hydroxyphenyl)-3-(3,4-dimethoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone.
Chemical Property Profile of 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone
Property Insights of 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone
The XLogP value of 3.7604 indicates that 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone. Following Lipinski's Rule of Five, 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone has 1 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 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone?
The CAS number of 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone is 708221-61-8.
What is the molecular formula of 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone?
The molecular formula of 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone is C19H19ClN2O4.
What is the molecular weight of 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone?
The molecular weight of 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone is 374.10 g/mol.
Where can I buy 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone?
You can request a quote for 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-(5-chloro-2-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.