RefChem:464086
TL;DR: RefChem:464086 (CAS 311317-65-4) is a chemical compound with molecular formula C26H26N4O5 and molecular weight 474.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-1-(4-nitrophenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile
Also Known As: ChemDiv1_011096, 2-amino-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-1-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile, 2-amino-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-1-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, A1227/0056594, 2-amino-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-1-(4-nitrophenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile
| Molecular Formula | C26H26N4O5 |
|---|---|
| Molecular Weight | 474.19 g/mol |
| LogP | 4.55288 |
| Topological Polar Surface Area | 131.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 474.1903 |
| Heavy Atoms | 35 |
| Complexity | 1318.2427 |
Chemical Identifiers
| CAS Number | 311317-65-4 |
|---|---|
| SMILES | CC1(CC2=C(C(C(=C(N2C3=CC=C(C=C3)[N+](=O)[O-])N)C#N)C4=CC(=C(C=C4)OC)OC)C(=O)C1)C |
Product Overview
RefChem:464086 (CAS 311317-65-4), with molecular formula C26H26N4O5 and molecular weight 474.19 g/mol. IUPAC: 2-amino-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-1-(4-nitrophenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile.
Chemical Property Profile of RefChem:464086
Property Insights of RefChem:464086
The XLogP value of 4.55288 indicates that RefChem:464086 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.72 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:464086. Following Lipinski's Rule of Five, RefChem:464086 has 1 hydrogen bond donor(s) and 8 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 RefChem:464086?
The CAS number of RefChem:464086 is 311317-65-4.
What is the molecular formula of RefChem:464086?
The molecular formula of RefChem:464086 is C26H26N4O5.
What is the molecular weight of RefChem:464086?
The molecular weight of RefChem:464086 is 474.19 g/mol.
Where can I buy RefChem:464086?
You can request a quote for RefChem:464086 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:464086?
Yes, KEHONG BIO provides custom synthesis services for RefChem:464086 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.