RefChem:463116
TL;DR: RefChem:463116 (CAS 312267-19-9) is a chemical compound with molecular formula C26H27BrN4O and molecular weight 490.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-(4-bromophenyl)-4-[4-(diethylamino)phenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Also Known As: 2-amino-1-(4-bromophenyl)-4-[4-(diethylamino)phenyl]-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile, A1694/0072249, 2-Amino-1-(4-bromophenyl)-4-(4-(diethylamino)phenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 2-amino-1-(4-bromophenyl)-4-[4-(diethylamino)phenyl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 2-amino-1-(4-bromophenyl)-4-[4-(diethylamino)phenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile
| Molecular Formula | C26H27BrN4O |
|---|---|
| Molecular Weight | 490.14 g/mol |
| LogP | 5.60008 |
| Topological Polar Surface Area | 73.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 490.1368 |
| Heavy Atoms | 32 |
| Complexity | 1121.912 |
Chemical Identifiers
| CAS Number | 312267-19-9 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=C(C=C4)Br)N)C#N |
Product Overview
RefChem:463116 (CAS 312267-19-9), with molecular formula C26H27BrN4O and molecular weight 490.14 g/mol. IUPAC: 2-amino-1-(4-bromophenyl)-4-[4-(diethylamino)phenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile.
Chemical Property Profile of RefChem:463116
Property Insights of RefChem:463116
The XLogP value of 5.60008 indicates that RefChem:463116 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.36 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:463116. Following Lipinski's Rule of Five, RefChem:463116 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:463116?
The CAS number of RefChem:463116 is 312267-19-9.
What is the molecular formula of RefChem:463116?
The molecular formula of RefChem:463116 is C26H27BrN4O.
What is the molecular weight of RefChem:463116?
The molecular weight of RefChem:463116 is 490.14 g/mol.
Where can I buy RefChem:463116?
You can request a quote for RefChem:463116 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:463116?
Yes, KEHONG BIO provides custom synthesis services for RefChem:463116 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.