2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione
TL;DR: 2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione (CAS 23419-96-7) is a chemical compound with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-bis(prop-2-enylamino)cyclohexa-2,5-diene-1,4-dione
Also Known As: 2,5-bis(allylamino)-1,4-benzoquinone, 2,5-bis(allylamino)cyclohexa-2,5-diene-1,4-dione, 2,5-bis(prop-2-enylamino)cyclohexa-2,5-diene-1,4-dione, 2,5-bis(prop-2-en-1-ylamino)cyclohexa-2,5-diene-1,4-dione
| Molecular Formula | C12H14N2O2 |
|---|---|
| Molecular Weight | 218.11 g/mol |
| LogP | 0.4572 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 218.10553 |
| Heavy Atoms | 16 |
| Complexity | 353.82294 |
Chemical Identifiers
| CAS Number | 23419-96-7 |
|---|---|
| SMILES | C=CCNC1=CC(=O)C(=CC1=O)NCC=C |
Product Overview
2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione (CAS 23419-96-7), with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol. IUPAC: 2,5-bis(prop-2-enylamino)cyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of 2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione
Property Insights of 2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione
The XLogP value of 0.4572 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione. With a topological polar surface area (TPSA) of 58.2 Ų, 2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione has 2 hydrogen bond donor(s) and 4 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 2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione?
The CAS number of 2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione is 23419-96-7.
What is the molecular formula of 2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione?
The molecular formula of 2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione is C12H14N2O2.
What is the molecular weight of 2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione?
The molecular weight of 2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione is 218.11 g/mol.
Where can I buy 2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione?
You can request a quote for 2,5-Bis(allylamino)cyclohexa-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-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Bis(allylamino)cyclohexa-2,5-diene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.