N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine
TL;DR: N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine (CAS 20398-76-9) is a chemical compound with molecular formula C6H4Br2N2 and molecular weight 261.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N,4-N-dibromocyclohexa-2,5-diene-1,4-diimine
Also Known As: [1,4]benzoquinone-bis-bromoimine|N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine|2,5-Cyclohexadiene-1,4-diimine, N,N'-dibromo-|1-N,4-N-dibromocyclohexa-2,5-diene-1,4-diimine|4-07-00-02073 (Beilstein Handbook Reference)|N1,N4-Dibromo-2,5-cyclohexadiene-1,4-diimine|N1,N4-dibromocyclohexa-2,5-diene-1,4-diimine|2,5-Cyclohexadiene-1,4-diimine, N1,N4-dibromo-|(1Z,4Z)-N,N'-Dibromocyclohexa-2,5-diene-1,4-diimine|BRN 3237701|UNII-4FU8P79YNB
| Molecular Formula | C6H4Br2N2 |
|---|---|
| Molecular Weight | 261.87 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 24.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 263.87207 |
| Heavy Atoms | 10 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 20398-76-9 |
|---|---|
| SMILES | C1=CC(=NBr)C=CC1=NBr |
| InChIKey | MQBZNSYRFPFFHP-UHFFFAOYSA-N |
Product Overview
N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine (CAS 20398-76-9), with molecular formula C6H4Br2N2 and molecular weight 261.87 g/mol. IUPAC: 1-N,4-N-dibromocyclohexa-2,5-diene-1,4-diimine.
Chemical Property Profile of N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine
Property Insights of N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine. With a topological polar surface area (TPSA) of 24.7 Ų, N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine has 0 hydrogen bond donor(s) and 2 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 N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine?
The CAS number of N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine is 20398-76-9.
What is the molecular formula of N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine?
The molecular formula of N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine is C6H4Br2N2.
What is the molecular weight of N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine?
The molecular weight of N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine is 261.87 g/mol.
Where can I buy N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine?
You can request a quote for N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine?
Yes, KEHONG BIO provides custom synthesis services for N,N'-Dibromo-2,5-cyclohexadiene-1,4-diimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.