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11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline
TL;DR: 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline (CAS 56514-61-5) is a chemical compound with molecular formula C14H16N2 and molecular weight 212.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline
Also Known As: 2-Amino-3-butenoicacid, 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline, 1H-Azepino[4,5-b]quinoline, 2,3,4,5-tetrahydro-11-methyl-, 1,2,4,5-tetrahydro-11-methyl-azepino[4,5-b]quinoline, 1,2,4,5-tetrahydro-11-methyl-3H-azepino[4,5-b]quinoline
| Molecular Formula | C14H16N2 |
|---|---|
| Molecular Weight | 212.13 g/mol |
| LogP | 2.23142 |
| Topological Polar Surface Area | 24.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 212.13135 |
| Heavy Atoms | 16 |
| Complexity | 531.4915 |
Chemical Identifiers
| CAS Number | 56514-61-5 |
|---|---|
| SMILES | CC1=C2CCNCCC2=NC3=CC=CC=C13 |
Product Overview
11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline (CAS 56514-61-5), with molecular formula C14H16N2 and molecular weight 212.13 g/mol. IUPAC: 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline.
Chemical Property Profile of 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline
Property Insights of 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline
The XLogP value of 2.23142 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline. With a topological polar surface area (TPSA) of 24.92 Ų, 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline has 1 hydrogen bond donor(s) and 2 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 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline?
The CAS number of 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline is 56514-61-5.
What is the molecular formula of 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline?
The molecular formula of 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline is C14H16N2.
What is the molecular weight of 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline?
The molecular weight of 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline is 212.13 g/mol.
Where can I buy 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline?
You can request a quote for 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline?
Yes, KEHONG BIO provides custom synthesis services for 11-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.