2,5-Bis(butylamino)cyclohexa-2,5-diene-1,4-dione
TL;DR: 2,5-Bis(butylamino)cyclohexa-2,5-diene-1,4-dione (CAS 183-97-1) is a chemical compound with molecular formula C14H22N2O2 and molecular weight 250.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-bis(butylamino)cyclohexa-2,5-diene-1,4-dione
Also Known As: Dodekadeuterio-perylen, 2,5-Bis(butylamino)chinon, 2,5-bis(butylamino)cyclohexa-2,5-diene-1,4-dione, 2,5-Bis(butylamino)-1,4-benzoquinone, 1,4-Cyclohexanedione Bis(ethyleneketal)
| Molecular Formula | C14H22N2O2 |
|---|---|
| Molecular Weight | 250.17 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 250.16812 |
| Heavy Atoms | 18 |
| Complexity | 334.0 |
Chemical Identifiers
| CAS Number | 183-97-1 |
|---|---|
| SMILES | CCCCNC1=CC(=O)C(=CC1=O)NCCCC |
| InChIKey | DUZAFCNACLLQPK-UHFFFAOYSA-N |
Product Overview
2,5-Bis(butylamino)cyclohexa-2,5-diene-1,4-dione (CAS 183-97-1), with molecular formula C14H22N2O2 and molecular weight 250.17 g/mol. IUPAC: 2,5-bis(butylamino)cyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of 2,5-Bis(butylamino)cyclohexa-2,5-diene-1,4-dione
Property Insights of 2,5-Bis(butylamino)cyclohexa-2,5-diene-1,4-dione
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Bis(butylamino)cyclohexa-2,5-diene-1,4-dione. With a topological polar surface area (TPSA) of 58.2 Ų, 2,5-Bis(butylamino)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(butylamino)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(butylamino)cyclohexa-2,5-diene-1,4-dione?
The CAS number of 2,5-Bis(butylamino)cyclohexa-2,5-diene-1,4-dione is 183-97-1.
What is the molecular formula of 2,5-Bis(butylamino)cyclohexa-2,5-diene-1,4-dione?
The molecular formula of 2,5-Bis(butylamino)cyclohexa-2,5-diene-1,4-dione is C14H22N2O2.
What is the molecular weight of 2,5-Bis(butylamino)cyclohexa-2,5-diene-1,4-dione?
The molecular weight of 2,5-Bis(butylamino)cyclohexa-2,5-diene-1,4-dione is 250.17 g/mol.
Where can I buy 2,5-Bis(butylamino)cyclohexa-2,5-diene-1,4-dione?
You can request a quote for 2,5-Bis(butylamino)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(butylamino)cyclohexa-2,5-diene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Bis(butylamino)cyclohexa-2,5-diene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.