4,11-Diazadibenzo(a,h)pyrene
TL;DR: 4,11-Diazadibenzo(a,h)pyrene (CAS 16566-62-4) is a chemical compound with molecular formula C22H12N2 and molecular weight 304.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,14-diazahexacyclo[10.10.2.02,7.09,23.013,18.020,24]tetracosa-1,3,5,7,9(23),10,12,14,16,18,20(24),21-dodecaene
Also Known As: Quinoline, 8-bromo-, 4,11-Diazadibenzo(a,h)pyrene, 3,10-Diazadibenzo(d,k)pyrene, Dipyrido(2,3-d,2,3-k)pyrene, 4-[3]pyridylazo-resorcinol
| Molecular Formula | C22H12N2 |
|---|---|
| Molecular Weight | 304.10 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 304.10004 |
| Heavy Atoms | 24 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 16566-62-4 |
|---|---|
| SMILES | C1=CC2=CC3=C4C(=C2N=C1)C=CC5=C4C(=C6C(=C5)C=CC=N6)C=C3 |
| InChIKey | NOTNAPGVLJPNRJ-UHFFFAOYSA-N |
Product Overview
4,11-Diazadibenzo(a,h)pyrene (CAS 16566-62-4), with molecular formula C22H12N2 and molecular weight 304.10 g/mol. IUPAC: 3,14-diazahexacyclo[10.10.2.02,7.09,23.013,18.020,24]tetracosa-1,3,5,7,9(23),10,12,14,16,18,20(24),21-dodecaene.
Chemical Property Profile of 4,11-Diazadibenzo(a,h)pyrene
Property Insights of 4,11-Diazadibenzo(a,h)pyrene
The XLogP value of 5.6 indicates that 4,11-Diazadibenzo(a,h)pyrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.8 Ų, 4,11-Diazadibenzo(a,h)pyrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,11-Diazadibenzo(a,h)pyrene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,11-Diazadibenzo(a,h)pyrene?
The CAS number of 4,11-Diazadibenzo(a,h)pyrene is 16566-62-4.
What is the molecular formula of 4,11-Diazadibenzo(a,h)pyrene?
The molecular formula of 4,11-Diazadibenzo(a,h)pyrene is C22H12N2.
What is the molecular weight of 4,11-Diazadibenzo(a,h)pyrene?
The molecular weight of 4,11-Diazadibenzo(a,h)pyrene is 304.10 g/mol.
Where can I buy 4,11-Diazadibenzo(a,h)pyrene?
You can request a quote for 4,11-Diazadibenzo(a,h)pyrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,11-Diazadibenzo(a,h)pyrene?
Yes, KEHONG BIO provides custom synthesis services for 4,11-Diazadibenzo(a,h)pyrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.