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4-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one
TL;DR: 4-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one (CAS 53304-34-0) is a chemical compound with molecular formula C18H11N3O and molecular weight 285.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15-amino-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-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one, 4-amino-7H-benzimidazo[2,1-a]benzo[de]isoquinolin-7-one, 15-amino-3,10-diazapentacyclo[10.7.1.02,10.04,9.016,20]icosa-1(20),2,4,6,8,12,14,16,18-nonaen-11-one
| Molecular Formula | C18H11N3O |
|---|---|
| Molecular Weight | 285.09 g/mol |
| LogP | 3.1741 |
| Topological Polar Surface Area | 60.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 285.0902 |
| Heavy Atoms | 22 |
| Complexity | 1253.772 |
Chemical Identifiers
| CAS Number | 53304-34-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C3N2C(=O)C4=C5C3=CC=CC5=C(C=C4)N |
Product Overview
4-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one (CAS 53304-34-0), with molecular formula C18H11N3O and molecular weight 285.09 g/mol. IUPAC: 15-amino-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-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one
Property Insights of 4-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one
The XLogP value of 3.1741 indicates that 4-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one. Following Lipinski's Rule of Five, 4-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one 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 4-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one?
The CAS number of 4-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one is 53304-34-0.
What is the molecular formula of 4-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one?
The molecular formula of 4-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one is C18H11N3O.
What is the molecular weight of 4-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one?
The molecular weight of 4-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one is 285.09 g/mol.
Where can I buy 4-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one?
You can request a quote for 4-Amino-7H-benzimidazo[2,1-a]benz[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-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.