Benz(a)anthracen-5-amine
TL;DR: Benz(a)anthracen-5-amine (CAS 56961-59-2) is a chemical compound with molecular formula C18H13N and molecular weight 243.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzo[a]anthracen-5-amine
Also Known As: Benz[a]anthracen-5-amine, tetraphen-5-amine, Benz(a)anthracen-5-amine, Benz anthracen-5-amine, benzo[a]anthracen-5-amine
| Molecular Formula | C18H13N |
|---|---|
| Molecular Weight | 243.10 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 243.1048 |
| Heavy Atoms | 19 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 56961-59-2 |
|---|---|
| SMILES | C1=CC=C2C=C3C4=CC=CC=C4C(=CC3=CC2=C1)N |
| InChIKey | DKHRIQWFPJKAMQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benz(a)anthracen-5-amine (CAS 56961-59-2), with molecular formula C18H13N and molecular weight 243.10 g/mol. IUPAC: benzo[a]anthracen-5-amine.
Chemical Property Profile of Benz(a)anthracen-5-amine
Property Insights of Benz(a)anthracen-5-amine
The XLogP value of 5.0 indicates that Benz(a)anthracen-5-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, Benz(a)anthracen-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benz(a)anthracen-5-amine has 1 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 Benz(a)anthracen-5-amine?
The CAS number of Benz(a)anthracen-5-amine is 56961-59-2.
What is the molecular formula of Benz(a)anthracen-5-amine?
The molecular formula of Benz(a)anthracen-5-amine is C18H13N.
What is the molecular weight of Benz(a)anthracen-5-amine?
The molecular weight of Benz(a)anthracen-5-amine is 243.10 g/mol.
Where can I buy Benz(a)anthracen-5-amine?
You can request a quote for Benz(a)anthracen-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benz(a)anthracen-5-amine?
Yes, KEHONG BIO provides custom synthesis services for Benz(a)anthracen-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.