ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)-
TL;DR: ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)- (CAS 73791-28-3) is a chemical compound with molecular formula C31H16N2O2 and molecular weight 448.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14-(7-oxobenzo[a]phenalen-1-yl)-14,15-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2,4,6,9(16),10,12-heptaen-8-one
Also Known As: Pyron [Czech], Pyron, N-Bz-3-Benzanthronylpyrazolanthron, N-Bz-3-Benzanthronylpyrazolanthron [Czech], 5-24-04-00481 (Beilstein Handbook Reference)
| Molecular Formula | C31H16N2O2 |
|---|---|
| Molecular Weight | 448.12 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 448.1212 |
| Heavy Atoms | 35 |
| Complexity | 887.0 |
Chemical Identifiers
| CAS Number | 73791-28-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(C=CC4=C3C(=CC=C4)C2=O)N5C6=CC=CC7=C6C(=N5)C8=CC=CC=C8C7=O |
| InChIKey | NQBKFULMFQMZBE-UHFFFAOYSA-N |
Product Overview
ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)- (CAS 73791-28-3), with molecular formula C31H16N2O2 and molecular weight 448.12 g/mol. IUPAC: 14-(7-oxobenzo[a]phenalen-1-yl)-14,15-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2,4,6,9(16),10,12-heptaen-8-one.
Chemical Property Profile of ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)-
Property Insights of ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)-
The XLogP value of 6.8 indicates that ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.0 Ų, ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)- 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 ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)-?
The CAS number of ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)- is 73791-28-3.
What is the molecular formula of ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)-?
The molecular formula of ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)- is C31H16N2O2.
What is the molecular weight of ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)-?
The molecular weight of ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)- is 448.12 g/mol.
Where can I buy ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)-?
You can request a quote for ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)-?
Yes, KEHONG BIO provides custom synthesis services for ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.