3-(4a,8a-Dihydroquinoxalin-2-yl)aniline
TL;DR: 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline (CAS 439095-37-1) is a chemical compound with molecular formula C14H13N3 and molecular weight 223.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4a,8a-dihydroquinoxalin-2-yl)aniline
Also Known As: 3-(4a,8a-dihydroquinoxalin-2-yl)aniline
| Molecular Formula | C14H13N3 |
|---|---|
| Molecular Weight | 223.11 g/mol |
| LogP | 2.0055 |
| Topological Polar Surface Area | 50.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.11095 |
| Heavy Atoms | 17 |
| Complexity | 552.3407 |
Chemical Identifiers
| CAS Number | 439095-37-1 |
|---|---|
| SMILES | C1=CC2C(C=C1)N=C(C=N2)C3=CC(=CC=C3)N |
Product Overview
3-(4a,8a-Dihydroquinoxalin-2-yl)aniline (CAS 439095-37-1), with molecular formula C14H13N3 and molecular weight 223.11 g/mol. IUPAC: 3-(4a,8a-dihydroquinoxalin-2-yl)aniline.
Chemical Property Profile of 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline
Property Insights of 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline
The XLogP value of 2.0055 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline. With a topological polar surface area (TPSA) of 50.74 Ų, 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline 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 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline?
The CAS number of 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline is 439095-37-1.
What is the molecular formula of 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline?
The molecular formula of 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline is C14H13N3.
What is the molecular weight of 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline?
The molecular weight of 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline is 223.11 g/mol.
Where can I buy 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline?
You can request a quote for 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 3-(4a,8a-Dihydroquinoxalin-2-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.