4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate
TL;DR: 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate (CAS 477730-09-9) is a chemical compound with molecular formula C25H20N2O6 and molecular weight 444.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-(1,3-benzodioxole-5-carbonylhydrazinylidene)methyl]-2-methoxyphenyl] (E)-3-phenylprop-2-enoate
Also Known As: 4-(2-(1,3-BENZODIOXOL-5-YLCARBONYL)CARBOHYDRAZONOYL)-2-MEO-PH 3-PHENYLACRYLATE, [4-[(benzo[1,3]dioxole-5-carbonylhydrazinylidene)methyl]-2-methoxy-phenyl] 3-phenylprop-2-enoate, 647-464-6, RefChem:511391
| Molecular Formula | C25H20N2O6 |
|---|---|
| Molecular Weight | 444.13 g/mol |
| LogP | 3.8066 |
| Topological Polar Surface Area | 95.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 444.13214 |
| Heavy Atoms | 33 |
| Complexity | 1220.8218 |
Chemical Identifiers
| CAS Number | 477730-09-9 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC3=C(C=C2)OCO3)OC(=O)/C=C/C4=CC=CC=C4 |
Product Overview
4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate (CAS 477730-09-9), with molecular formula C25H20N2O6 and molecular weight 444.13 g/mol. IUPAC: [4-[(E)-(1,3-benzodioxole-5-carbonylhydrazinylidene)methyl]-2-methoxyphenyl] (E)-3-phenylprop-2-enoate.
Chemical Property Profile of 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate
Property Insights of 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate
The XLogP value of 3.8066 indicates that 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate. Following Lipinski's Rule of Five, 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate has 1 hydrogen bond donor(s) and 7 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 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate?
The CAS number of 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate is 477730-09-9.
What is the molecular formula of 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate?
The molecular formula of 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate is C25H20N2O6.
What is the molecular weight of 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate?
The molecular weight of 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate is 444.13 g/mol.
Where can I buy 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate?
You can request a quote for 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-2-meo-PH 3-phenylacrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.