6-[(E)-carbohydrazonoyl]-2,3-dianisic acid
TL;DR: 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid (CAS 423752-00-5) is a chemical compound with molecular formula C26H30N4O5 and molecular weight 478.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(E)-[[3-(1H-benzimidazol-2-yl)-1,2,2-trimethylcyclopentanecarbonyl]hydrazinylidene]methyl]-2,3-dimethoxybenzoic acid
Also Known As: 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid, F1284-0731, (E)-6-((2-(3-(1H-benzo[d]imidazol-2-yl)-1,2,2-trimethylcyclopentanecarbonyl)hydrazono)methyl)-2,3-dimethoxybenzoic acid, 6-[(1E)-({[3-(1H-1,3-BENZODIAZOL-2-YL)-1,2,2-TRIMETHYLCYCLOPENTYL]FORMAMIDO}IMINO)METHYL]-2,3-DIMETHOXYBENZOIC ACID, 6-(2-{[3-(1H-1,3-BENZIMIDAZOL-2-YL)-1,2,2-TRIMETHYLCYCLOPENTYL]CARBONYL}CARBOHYDRAZONOYL)-2,3-DIMETHOXYBENZOIC ACID
| Molecular Formula | C26H30N4O5 |
|---|---|
| Molecular Weight | 478.22 g/mol |
| LogP | 4.3385 |
| Topological Polar Surface Area | 125.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 478.22162 |
| Heavy Atoms | 35 |
| Complexity | 1279.3145 |
Chemical Identifiers
| CAS Number | 423752-00-5 |
|---|---|
| SMILES | CC1(C(CCC1(C)C(=O)N/N=C/C2=C(C(=C(C=C2)OC)OC)C(=O)O)C3=NC4=CC=CC=C4N3)C |
Product Overview
6-[(E)-carbohydrazonoyl]-2,3-dianisic acid (CAS 423752-00-5), with molecular formula C26H30N4O5 and molecular weight 478.22 g/mol. IUPAC: 6-[(E)-[[3-(1H-benzimidazol-2-yl)-1,2,2-trimethylcyclopentanecarbonyl]hydrazinylidene]methyl]-2,3-dimethoxybenzoic acid.
Chemical Property Profile of 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid
Property Insights of 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid
The XLogP value of 4.3385 indicates that 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid. Following Lipinski's Rule of Five, 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid has 3 hydrogen bond donor(s) and 6 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 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid?
The CAS number of 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid is 423752-00-5.
What is the molecular formula of 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid?
The molecular formula of 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid is C26H30N4O5.
What is the molecular weight of 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid?
The molecular weight of 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid is 478.22 g/mol.
Where can I buy 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid?
You can request a quote for 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-[(E)-carbohydrazonoyl]-2,3-dianisic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.