2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
TL;DR: 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one (CAS 354541-73-4) is a chemical compound with molecular formula C21H20Cl2N2O3 and molecular weight 418.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-2-(3,4-dichlorophenyl)-4-[(3-methoxy-4-propoxyphenyl)methylidene]-5-methylpyrazol-3-one
Also Known As: 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one, (4E)-2-(3,4-dichlorophenyl)-4-[(3-methoxy-4-propoxyphenyl)methylidene]-5-methylpyrazol-3-one, 2-(3,4-DICHLOROPHENYL)-4-[(E)-1-(3-METHOXY-4-PROPOXYPHENYL)METHYLIDENE]-5-METHYL-2,4-DIHYDRO-3H-PYRAZOL-3-ONE
| Molecular Formula | C21H20Cl2N2O3 |
|---|---|
| Molecular Weight | 418.09 g/mol |
| LogP | 5.5969 |
| Topological Polar Surface Area | 51.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.08508 |
| Heavy Atoms | 28 |
| Complexity | 970.1182 |
Chemical Identifiers
| CAS Number | 354541-73-4 |
|---|---|
| SMILES | CCCOC1=C(C=C(C=C1)/C=C/2\C(=NN(C2=O)C3=CC(=C(C=C3)Cl)Cl)C)OC |
Product Overview
2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one (CAS 354541-73-4), with molecular formula C21H20Cl2N2O3 and molecular weight 418.09 g/mol. IUPAC: (4E)-2-(3,4-dichlorophenyl)-4-[(3-methoxy-4-propoxyphenyl)methylidene]-5-methylpyrazol-3-one.
Chemical Property Profile of 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Property Insights of 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
The XLogP value of 5.5969 indicates that 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.13 Ų, 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one?
The CAS number of 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one is 354541-73-4.
What is the molecular formula of 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one?
The molecular formula of 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one is C21H20Cl2N2O3.
What is the molecular weight of 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one?
The molecular weight of 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one is 418.09 g/mol.
Where can I buy 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one?
You can request a quote for 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-dichlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.