2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate
TL;DR: 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate (CAS 769154-18-9) is a chemical compound with molecular formula C25H21BrN2O6 and molecular weight 524.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(E)-(1,3-benzodioxole-5-carbonylhydrazinylidene)methyl]-4-bromophenyl] 4-propoxybenzoate
Also Known As: SALOR-INT L386456-1EA, 2-(2-(1,3-BENZODIOXOL-5-YLCARBONYL)CARBOHYDRAZONOYL)-4-BR-PH 4-PROPOXYBENZOATE, [2-[(benzo[1,3]dioxole-5-carbonylhydrazinylidene)methyl]-4-bromo-phenyl] 4-propoxybenzoate, 650-342-5, RefChem:452378
| Molecular Formula | C25H21BrN2O6 |
|---|---|
| Molecular Weight | 524.06 g/mol |
| LogP | 4.9497 |
| Topological Polar Surface Area | 95.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 524.0583 |
| Heavy Atoms | 34 |
| Complexity | 1226.5756 |
Chemical Identifiers
| CAS Number | 769154-18-9 |
|---|---|
| SMILES | CCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)C3=CC4=C(C=C3)OCO4 |
Product Overview
2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate (CAS 769154-18-9), with molecular formula C25H21BrN2O6 and molecular weight 524.06 g/mol. IUPAC: [2-[(E)-(1,3-benzodioxole-5-carbonylhydrazinylidene)methyl]-4-bromophenyl] 4-propoxybenzoate.
Chemical Property Profile of 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate
Property Insights of 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate
The XLogP value of 4.9497 indicates that 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate 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 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate. Following Lipinski's Rule of Five, 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate?
The CAS number of 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate is 769154-18-9.
What is the molecular formula of 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate?
The molecular formula of 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate is C25H21BrN2O6.
What is the molecular weight of 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate?
The molecular weight of 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate is 524.06 g/mol.
Where can I buy 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate?
You can request a quote for 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-(1,3-Benzodioxol-5-ylcarbonyl)carbohydrazonoyl)-4-BR-PH 4-propoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.