1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline
TL;DR: 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline (CAS 15745-16-1) is a chemical compound with molecular formula C14H17NO and molecular weight 215.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dihydro-2H-quinolin-1-yl)-3-methylbut-2-en-1-one
Also Known As: 1-(3-methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline, 1-(3,4-Dihydro-1(2H)-quinolinyl)-3-methyl-2-buten-1-one, AS-871/41746241, 1-(3,4-dihydro-2H-quinolin-1-yl)-3-methylbut-2-en-1-one, 3-methyl-1-(1,2,3,4-tetrahydroquinolyl)but-2-en-1-one
| Molecular Formula | C14H17NO |
|---|---|
| Molecular Weight | 215.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 215.13101 |
| Heavy Atoms | 16 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 15745-16-1 |
|---|---|
| SMILES | CC(=CC(=O)N1CCCC2=CC=CC=C21)C |
| InChIKey | LLDXRZZWHKLVLL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline (CAS 15745-16-1), with molecular formula C14H17NO and molecular weight 215.13 g/mol. IUPAC: 1-(3,4-dihydro-2H-quinolin-1-yl)-3-methylbut-2-en-1-one.
Chemical Property Profile of 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline
Property Insights of 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline
The XLogP value of 3.1 indicates that 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline has 0 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 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline?
The CAS number of 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline is 15745-16-1.
What is the molecular formula of 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline?
The molecular formula of 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline is C14H17NO.
What is the molecular weight of 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline?
The molecular weight of 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline is 215.13 g/mol.
Where can I buy 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline?
You can request a quote for 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Methyl-2-butenoyl)-1,2,3,4-tetrahydroquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.