2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone
TL;DR: 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone (CAS 13437-25-7) is a chemical compound with molecular formula C20H16Cl2N2O4 and molecular weight 418.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dichloro-3,6-bis(2-methoxyanilino)cyclohexa-2,5-diene-1,4-dione
Also Known As: Benzoquinone der., 2,5-dichloro-3,6-bis(2-methoxyanilino)cyclohexa-2,5-diene-1,4-dione, 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone, 2,5-dichloro-3,6-bis(2-methoxyanilino)-1,4-benzoquinone, 2,5-dichloro-3,6-bis(2-methoxyanilino)benzo-1,4-quinone
| Molecular Formula | C20H16Cl2N2O4 |
|---|---|
| Molecular Weight | 418.05 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.0487 |
| Heavy Atoms | 28 |
| Complexity | 634.0 |
Chemical Identifiers
| CAS Number | 13437-25-7 |
|---|---|
| SMILES | COC1=CC=CC=C1NC2=C(C(=O)C(=C(C2=O)Cl)NC3=CC=CC=C3OC)Cl |
| InChIKey | FMMAUQCYFYYBOR-UHFFFAOYSA-N |
Product Overview
2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone (CAS 13437-25-7), with molecular formula C20H16Cl2N2O4 and molecular weight 418.05 g/mol. IUPAC: 2,5-dichloro-3,6-bis(2-methoxyanilino)cyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone
Property Insights of 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone
The XLogP value of 5.2 indicates that 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone. Following Lipinski's Rule of Five, 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone?
The CAS number of 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone is 13437-25-7.
What is the molecular formula of 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone?
The molecular formula of 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone is C20H16Cl2N2O4.
What is the molecular weight of 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone?
The molecular weight of 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone is 418.05 g/mol.
Where can I buy 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone?
You can request a quote for 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Bis(2-methoxyanilino)-3,6-dichloro-1,4-benzoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.