1-(2-Bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline
TL;DR: 1-(2-Bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline (CAS 294642-70-9) is a chemical compound with molecular formula C13H16BrNO and molecular weight 281.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-one
Also Known As: 1-(2-bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline, J1.390.306I, AO-435/41051428, 2-bromo-2-methyl-1-(1,2,3,4-tetrahydroquinolin-1-yl)propan-1-one, 2-bromo-1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-one
| Molecular Formula | C13H16BrNO |
|---|---|
| Molecular Weight | 281.04 g/mol |
| LogP | 3.1393 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 281.04153 |
| Heavy Atoms | 16 |
| Complexity | 408.63876 |
Chemical Identifiers
| CAS Number | 294642-70-9 |
|---|---|
| SMILES | CC(C)(C(=O)N1CCCC2=CC=CC=C21)Br |
Product Overview
1-(2-Bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline (CAS 294642-70-9), with molecular formula C13H16BrNO and molecular weight 281.04 g/mol. IUPAC: 2-bromo-1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-one.
Chemical Property Profile of 1-(2-Bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline
Property Insights of 1-(2-Bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline
The XLogP value of 3.1393 indicates that 1-(2-Bromo-2-methylpropanoyl)-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 20.31 Ų, 1-(2-Bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Bromo-2-methylpropanoyl)-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-(2-Bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline?
The CAS number of 1-(2-Bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline is 294642-70-9.
What is the molecular formula of 1-(2-Bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline?
The molecular formula of 1-(2-Bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline is C13H16BrNO.
What is the molecular weight of 1-(2-Bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline?
The molecular weight of 1-(2-Bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline is 281.04 g/mol.
Where can I buy 1-(2-Bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline?
You can request a quote for 1-(2-Bromo-2-methylpropanoyl)-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-(2-Bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Bromo-2-methylpropanoyl)-1,2,3,4-tetrahydroquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.