2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile
TL;DR: 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile (CAS 369604-88-6) is a chemical compound with molecular formula C18H18BrN3O and molecular weight 371.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile
Also Known As: 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile, 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 2-amino-7,7-dimethyl-5-oxo-4-(2-bromophenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
| Molecular Formula | C18H18BrN3O |
|---|---|
| Molecular Weight | 371.06 g/mol |
| LogP | 3.47298 |
| Topological Polar Surface Area | 78.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 371.06332 |
| Heavy Atoms | 23 |
| Complexity | 798.72986 |
Chemical Identifiers
| CAS Number | 369604-88-6 |
|---|---|
| SMILES | CC1(CC2=C(C(C(=C(N2)N)C#N)C3=CC=CC=C3Br)C(=O)C1)C |
Product Overview
2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile (CAS 369604-88-6), with molecular formula C18H18BrN3O and molecular weight 371.06 g/mol. IUPAC: 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile.
Chemical Property Profile of 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile
Property Insights of 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile
The XLogP value of 3.47298 indicates that 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile. Following Lipinski's Rule of Five, 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile has 2 hydrogen bond donor(s) and 4 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 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile?
The CAS number of 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile is 369604-88-6.
What is the molecular formula of 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile?
The molecular formula of 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile is C18H18BrN3O.
What is the molecular weight of 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile?
The molecular weight of 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile is 371.06 g/mol.
Where can I buy 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile?
You can request a quote for 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.