RefChem:868891
TL;DR: RefChem:868891 (CAS 18178-47-7) is a chemical compound with molecular formula C26H28N4O2 and molecular weight 428.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-(2,2-dicyanoethenyl)-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl]ethyl N-phenylcarbamate
Also Known As: C.I. Disperse Yellow 88, 2-[6-(2,2-dicyanovinyl)-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1(2h)-yl]ethyl phenylcarbamate, 2-[6-(2,2-dicyanoethenyl)-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl]ethyl N-phenylcarbamate, 2-[6-(2,2-dicyanovinyl)-1,2,3,4-tetrahydro-2,2,4,7-tetramethylquinolin-1-yl]ethyl carbanilate, N-(2-[4-(Aminomethyl)phenoxy]ethyl)-n,n-diethylamine
| Molecular Formula | C26H28N4O2 |
|---|---|
| Molecular Weight | 428.22 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 89.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 428.22122 |
| Heavy Atoms | 32 |
| Complexity | 777.0 |
Chemical Identifiers
| CAS Number | 18178-47-7 |
|---|---|
| SMILES | CC1CC(N(C2=C1C=C(C(=C2)C)C=C(C#N)C#N)CCOC(=O)NC3=CC=CC=C3)(C)C |
| InChIKey | MBGQLEMLPRDFQM-UHFFFAOYSA-N |
Product Overview
RefChem:868891 (CAS 18178-47-7), with molecular formula C26H28N4O2 and molecular weight 428.22 g/mol. IUPAC: 2-[6-(2,2-dicyanoethenyl)-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl]ethyl N-phenylcarbamate.
Chemical Property Profile of RefChem:868891
Property Insights of RefChem:868891
The XLogP value of 5.1 indicates that RefChem:868891 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:868891. Following Lipinski's Rule of Five, RefChem:868891 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:868891?
The CAS number of RefChem:868891 is 18178-47-7.
What is the molecular formula of RefChem:868891?
The molecular formula of RefChem:868891 is C26H28N4O2.
What is the molecular weight of RefChem:868891?
The molecular weight of RefChem:868891 is 428.22 g/mol.
Where can I buy RefChem:868891?
You can request a quote for RefChem:868891 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:868891?
Yes, KEHONG BIO provides custom synthesis services for RefChem:868891 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.