(4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one
TL;DR: (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one (CAS 684238-67-3) is a chemical compound with molecular formula C19H18ClN3O3 and molecular weight 371.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-chloro-2,5-dimethoxyphenyl)iminomethyl]-5-methyl-2-phenyl-1H-pyrazol-3-one
Also Known As: (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one, 4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one, (4Z)-4-{[(4-CHLORO-2,5-DIMETHOXYPHENYL)AMINO]METHYLIDENE}-3-METHYL-1-PHENYL-4,5-DIHYDRO-1H-PYRAZOL-5-ONE, (4Z)-4-{[(4-chloro-2,5-dimethoxyphenyl)amino]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one, (Z)-4-(((4-chloro-2,5-dimethoxyphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one
| Molecular Formula | C19H18ClN3O3 |
|---|---|
| Molecular Weight | 371.10 g/mol |
| LogP | 3.89522 |
| Topological Polar Surface Area | 68.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.10367 |
| Heavy Atoms | 26 |
| Complexity | 1006.8591 |
Chemical Identifiers
| CAS Number | 684238-67-3 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=CC=CC=C2)C=NC3=CC(=C(C=C3OC)Cl)OC |
Product Overview
(4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one (CAS 684238-67-3), with molecular formula C19H18ClN3O3 and molecular weight 371.10 g/mol. IUPAC: 4-[(4-chloro-2,5-dimethoxyphenyl)iminomethyl]-5-methyl-2-phenyl-1H-pyrazol-3-one.
Chemical Property Profile of (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one
Property Insights of (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one
The XLogP value of 3.89522 indicates that (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.61 Ų falls within the moderate polarity range, balancing permeability and solubility for (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one. Following Lipinski's Rule of Five, (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one has 1 hydrogen bond donor(s) and 4 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 (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one?
The CAS number of (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one is 684238-67-3.
What is the molecular formula of (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one?
The molecular formula of (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one is C19H18ClN3O3.
What is the molecular weight of (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one?
The molecular weight of (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one is 371.10 g/mol.
Where can I buy (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one?
You can request a quote for (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for (4Z)-4-[(4-chloro-2,5-dimethoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.