2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione
TL;DR: 2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione (CAS 15080-56-5) is a chemical compound with molecular formula C18H12Br2N2O2 and molecular weight 445.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione
Also Known As: 2,5-dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione, 2,5-dianilino-3,6-dibromo-1,4-benzoquinone, 2,5-Dianilino-3,6-dibromo-p-benzoquinone, 2,5-Bis[(phenyl)amino]-3,6-dibromo-2,5-cyclohexadiene-1,4-dione, 2,5-dibromo-3,6-bis(phenylamino)cyclohexa-2,5-diene-1,4-dione
| Molecular Formula | C18H12Br2N2O2 |
|---|---|
| Molecular Weight | 445.93 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 445.92654 |
| Heavy Atoms | 24 |
| Complexity | 534.0 |
Chemical Identifiers
| CAS Number | 15080-56-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=C(C(=O)C(=C(C2=O)Br)NC3=CC=CC=C3)Br |
| InChIKey | SIHXJQMPAMPGDJ-UHFFFAOYSA-N |
Product Overview
2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione (CAS 15080-56-5), with molecular formula C18H12Br2N2O2 and molecular weight 445.93 g/mol. IUPAC: 2,5-dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of 2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione
Property Insights of 2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione
The XLogP value of 5.3 indicates that 2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, 2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione has 2 hydrogen bond donor(s) and 4 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-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione?
The CAS number of 2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione is 15080-56-5.
What is the molecular formula of 2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione?
The molecular formula of 2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione is C18H12Br2N2O2.
What is the molecular weight of 2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione?
The molecular weight of 2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione is 445.93 g/mol.
Where can I buy 2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione?
You can request a quote for 2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dianilino-3,6-dibromocyclohexa-2,5-diene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.