1-Acetamidopyrene-4,5-quinone
TL;DR: 1-Acetamidopyrene-4,5-quinone (CAS 180913-77-3) is a chemical compound with molecular formula C18H11NO3 and molecular weight 289.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4,5-dioxopyren-1-yl)acetamide
Also Known As: Fusacandin C, 1-Acetamidopyrene-4,5-quinone, N-(4,5-dioxopyren-1-yl)acetamide, Acetamide, N-(4,5-dihydro-4,5-dioxo-1-pyrenyl)-, N-(4,5-Dihydro-4,5-dioxo-1-pyrenyl)acetamide
| Molecular Formula | C18H11NO3 |
|---|---|
| Molecular Weight | 289.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 289.07388 |
| Heavy Atoms | 22 |
| Complexity | 528.0 |
Chemical Identifiers
| CAS Number | 180913-77-3 |
|---|---|
| SMILES | CC(=O)NC1=C2C=CC3=C4C2=C(C=C1)C(=O)C(=O)C4=CC=C3 |
| InChIKey | IKVXMGABJCJXTD-UHFFFAOYSA-N |
Product Overview
1-Acetamidopyrene-4,5-quinone (CAS 180913-77-3), with molecular formula C18H11NO3 and molecular weight 289.07 g/mol. IUPAC: N-(4,5-dioxopyren-1-yl)acetamide.
Chemical Property Profile of 1-Acetamidopyrene-4,5-quinone
Property Insights of 1-Acetamidopyrene-4,5-quinone
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Acetamidopyrene-4,5-quinone. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Acetamidopyrene-4,5-quinone. Following Lipinski's Rule of Five, 1-Acetamidopyrene-4,5-quinone has 1 hydrogen bond donor(s) and 3 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 1-Acetamidopyrene-4,5-quinone?
The CAS number of 1-Acetamidopyrene-4,5-quinone is 180913-77-3.
What is the molecular formula of 1-Acetamidopyrene-4,5-quinone?
The molecular formula of 1-Acetamidopyrene-4,5-quinone is C18H11NO3.
What is the molecular weight of 1-Acetamidopyrene-4,5-quinone?
The molecular weight of 1-Acetamidopyrene-4,5-quinone is 289.07 g/mol.
Where can I buy 1-Acetamidopyrene-4,5-quinone?
You can request a quote for 1-Acetamidopyrene-4,5-quinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Acetamidopyrene-4,5-quinone?
Yes, KEHONG BIO provides custom synthesis services for 1-Acetamidopyrene-4,5-quinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.