![4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one structure](/static/products/2135/21357-90-4.webp)
4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one
TL;DR: 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one (CAS 21357-90-4) is a chemical compound with molecular formula C20H12N2O2 and molecular weight 312.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15-acetyl-3,10-diazapentacyclo[10.7.1.02,10.04,9.016,20]icosa-1(19),2,4,6,8,12(20),13,15,17-nonaen-11-one
Also Known As: 4-ACETYL-7H-[1,3]BENZIMIDAZO[2,1-A]BENZO[DE]ISOQUINOLIN-7-ONE, 4-acetyl-benzo[de]benzo[4,5]imidazo[2,1-a]isoquinolin-7-one, 15-Acetyl-3,10-diazapentacyclo[10.7.1.02,10.04,9.016,20]icosa-1(19),2,4,6,8,12(20),13,15,17-nonaen-11-one
| Molecular Formula | C20H12N2O2 |
|---|---|
| Molecular Weight | 312.09 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 312.08987 |
| Heavy Atoms | 24 |
| Complexity | 562.0 |
Chemical Identifiers
| CAS Number | 21357-90-4 |
|---|---|
| SMILES | CC(=O)C1=C2C=CC=C3C2=C(C=C1)C(=O)N4C3=NC5=CC=CC=C54 |
| InChIKey | YTRBMKKIWQIJKJ-UHFFFAOYSA-N |
Product Overview
4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one (CAS 21357-90-4), with molecular formula C20H12N2O2 and molecular weight 312.09 g/mol. IUPAC: 15-acetyl-3,10-diazapentacyclo[10.7.1.02,10.04,9.016,20]icosa-1(19),2,4,6,8,12(20),13,15,17-nonaen-11-one.
Chemical Property Profile of 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one
Property Insights of 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one
The XLogP value of 3.7 indicates that 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.0 Ų, 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one has 0 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 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one?
The CAS number of 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one is 21357-90-4.
What is the molecular formula of 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one?
The molecular formula of 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one is C20H12N2O2.
What is the molecular weight of 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one?
The molecular weight of 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one is 312.09 g/mol.
Where can I buy 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one?
You can request a quote for 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Acetyl-7H-[1,3]benzimidazo[2,1-A]benzo[DE]isoquinolin-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.