(E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide
TL;DR: (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide (CAS 1164524-69-9) is a chemical compound with molecular formula C21H23Cl2N5O and molecular weight 431.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide
Also Known As: (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide, N-[1-(2,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-3-(1-ethyl-5-methyl-1H-pyrazol-4-yl)acrylamide, (2E)-N-[1-(2,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-3-(1-ethyl-5-methyl-1H-pyrazol-4-yl)prop-2-enamide, (E)-N-[1-(2,4-DICHLOROBENZYL)-3,5-DIMETHYL-1H-PYRAZOL-4-YL]-3-(1-ETHYL-5-METHYL-1H-PYRAZOL-4-YL)-2-PROPENAMIDE
| Molecular Formula | C21H23Cl2N5O |
|---|---|
| Molecular Weight | 431.13 g/mol |
| LogP | 5.03176 |
| Topological Polar Surface Area | 64.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.12796 |
| Heavy Atoms | 29 |
| Complexity | 1081.1747 |
Chemical Identifiers
| CAS Number | 1164524-69-9 |
|---|---|
| SMILES | CCN1C(=C(C=N1)/C=C/C(=O)NC2=C(N(N=C2C)CC3=C(C=C(C=C3)Cl)Cl)C)C |
Product Overview
(E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide (CAS 1164524-69-9), with molecular formula C21H23Cl2N5O and molecular weight 431.13 g/mol. IUPAC: (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide.
Chemical Property Profile of (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide
Property Insights of (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide
The XLogP value of 5.03176 indicates that (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.74 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide. Following Lipinski's Rule of Five, (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide?
The CAS number of (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide is 1164524-69-9.
What is the molecular formula of (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide?
The molecular formula of (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide is C21H23Cl2N5O.
What is the molecular weight of (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide?
The molecular weight of (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide is 431.13 g/mol.
Where can I buy (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide?
You can request a quote for (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.