Naphtho(2,1,8-def)quinoline
TL;DR: Naphtho(2,1,8-def)quinoline (CAS 313-80-4) is a chemical compound with molecular formula C15H9N and molecular weight 203.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-azatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),2,4,6,8(16),9,11(15),12-octaene
Also Known As: 1-Azapyrene, Zapyrene, Azapyrene, naphtho[2,1,8-def]quinoline, NAPHTHO(2,1,8-DEF)QUINOLINE
| Molecular Formula | C15H9N |
|---|---|
| Molecular Weight | 203.07 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 203.0735 |
| Heavy Atoms | 16 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 313-80-4 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=CC4=NC=CC(=C43)C=C2 |
| InChIKey | QHADMMAFBAZFTE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Naphtho(2,1,8-def)quinoline (CAS 313-80-4), with molecular formula C15H9N and molecular weight 203.07 g/mol. IUPAC: 5-azatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),2,4,6,8(16),9,11(15),12-octaene.
Chemical Property Profile of Naphtho(2,1,8-def)quinoline
Property Insights of Naphtho(2,1,8-def)quinoline
The XLogP value of 4.0 indicates that Naphtho(2,1,8-def)quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.9 Ų, Naphtho(2,1,8-def)quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphtho(2,1,8-def)quinoline has 0 hydrogen bond donor(s) and 1 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 Naphtho(2,1,8-def)quinoline?
The CAS number of Naphtho(2,1,8-def)quinoline is 313-80-4.
What is the molecular formula of Naphtho(2,1,8-def)quinoline?
The molecular formula of Naphtho(2,1,8-def)quinoline is C15H9N.
What is the molecular weight of Naphtho(2,1,8-def)quinoline?
The molecular weight of Naphtho(2,1,8-def)quinoline is 203.07 g/mol.
Where can I buy Naphtho(2,1,8-def)quinoline?
You can request a quote for Naphtho(2,1,8-def)quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphtho(2,1,8-def)quinoline?
Yes, KEHONG BIO provides custom synthesis services for Naphtho(2,1,8-def)quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.