Dioc(7)
TL;DR: Dioc(7) (CAS 79953-80-3) is a chemical compound with molecular formula C31H41N2O2+ and molecular weight 473.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-3-heptyl-2-[(E)-3-(3-heptyl-1,3-benzoxazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzoxazole
Also Known As: Dioc(7), 3,3'-Dhpcc, Dioc7(3), 3,3'-Diheptyloxycarbocyanine, Benzoxazolium, 3-heptyl-2-(3-(3-heptyl-2(3H)-benzoxazolylidene)-1-propenyl)-
| Molecular Formula | C31H41N2O2+ |
|---|---|
| Molecular Weight | 473.32 g/mol |
| LogP | 8.4147 |
| Topological Polar Surface Area | 29.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 14 |
| Exact Mass | 473.3168 |
| Heavy Atoms | 35 |
| Complexity | 1127.9685 |
Chemical Identifiers
| CAS Number | 79953-80-3 |
|---|---|
| SMILES | CCCCCCCN\1C2=CC=CC=C2O/C1=C\C=C\C3=[N+](C4=CC=CC=C4O3)CCCCCCC |
Product Overview
Dioc(7) (CAS 79953-80-3), with molecular formula C31H41N2O2+ and molecular weight 473.32 g/mol. IUPAC: (2Z)-3-heptyl-2-[(E)-3-(3-heptyl-1,3-benzoxazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzoxazole.
Chemical Property Profile of Dioc(7)
Property Insights of Dioc(7)
The XLogP value of 8.4147 indicates that Dioc(7) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.49 Ų, Dioc(7) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dioc(7) has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dioc(7)?
The CAS number of Dioc(7) is 79953-80-3.
What is the molecular formula of Dioc(7)?
The molecular formula of Dioc(7) is C31H41N2O2+.
What is the molecular weight of Dioc(7)?
The molecular weight of Dioc(7) is 473.32 g/mol.
Where can I buy Dioc(7)?
You can request a quote for Dioc(7) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dioc(7)?
Yes, KEHONG BIO provides custom synthesis services for Dioc(7) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.