RefChem:463126
TL;DR: RefChem:463126 (CAS 311764-52-0) is a chemical compound with molecular formula C25H24BrN3O4 and molecular weight 509.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-(4-bromophenyl)-5-oxo-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Also Known As: Salor-int l221910-1ea, 2-amino-1-(4-bromophenyl)-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile, 2-amino-1-(4-bromophenyl)-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, A1344/0060681, 2-amino-1-(4-bromophenyl)-5-oxo-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
| Molecular Formula | C25H24BrN3O4 |
|---|---|
| Molecular Weight | 509.10 g/mol |
| LogP | 4.77968 |
| Topological Polar Surface Area | 97.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 509.09503 |
| Heavy Atoms | 33 |
| Complexity | 1186.1432 |
Chemical Identifiers
| CAS Number | 311764-52-0 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=C(C=C4)Br)N)C#N |
Product Overview
RefChem:463126 (CAS 311764-52-0), with molecular formula C25H24BrN3O4 and molecular weight 509.10 g/mol. IUPAC: 2-amino-1-(4-bromophenyl)-5-oxo-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile.
Chemical Property Profile of RefChem:463126
Property Insights of RefChem:463126
The XLogP value of 4.77968 indicates that RefChem:463126 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.81 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:463126. Following Lipinski's Rule of Five, RefChem:463126 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:463126?
The CAS number of RefChem:463126 is 311764-52-0.
What is the molecular formula of RefChem:463126?
The molecular formula of RefChem:463126 is C25H24BrN3O4.
What is the molecular weight of RefChem:463126?
The molecular weight of RefChem:463126 is 509.10 g/mol.
Where can I buy RefChem:463126?
You can request a quote for RefChem:463126 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:463126?
Yes, KEHONG BIO provides custom synthesis services for RefChem:463126 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.