RefChem:322870
TL;DR: RefChem:322870 (CAS 54268-71-2) is a chemical compound with molecular formula C21H26N2 and molecular weight 306.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-4-[2-(1,3,3-trimethyl-2H-indol-2-yl)ethenyl]aniline
Also Known As: N,N-Dimethyl-4-[2- ethenyl]benzenamine, Benzenamine, 4-[2-(2,3-dihydro-1,3,3-trimethyl-1H-indol-2-yl)ethenyl]-N,N-dimethyl-, 4-(2-(2,3-Dihydro-1,3,3-trimethyl-1H-indol-2-yl)ethenyl)-N,N-dimethylbenzenamine, Benzenamine, 4-(2-(2,3-dihydro-1,3,3-trimethyl-1H-indol-2-yl)ethenyl)-N,N-dimethyl-, N,N-dimethyl-4-[2-(1,3,3-trimethyl-2H-indol-2-yl)ethenyl]aniline
| Molecular Formula | C21H26N2 |
|---|---|
| Molecular Weight | 306.21 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.2096 |
| Heavy Atoms | 23 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 54268-71-2 |
|---|---|
| SMILES | CC1(C(N(C2=CC=CC=C21)C)C=CC3=CC=C(C=C3)N(C)C)C |
| InChIKey | VGWSUVRKHUPJBD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:322870 (CAS 54268-71-2), with molecular formula C21H26N2 and molecular weight 306.21 g/mol. IUPAC: N,N-dimethyl-4-[2-(1,3,3-trimethyl-2H-indol-2-yl)ethenyl]aniline.
Chemical Property Profile of RefChem:322870
Property Insights of RefChem:322870
The XLogP value of 5.2 indicates that RefChem:322870 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.5 Ų, RefChem:322870 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:322870 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:322870?
The CAS number of RefChem:322870 is 54268-71-2.
What is the molecular formula of RefChem:322870?
The molecular formula of RefChem:322870 is C21H26N2.
What is the molecular weight of RefChem:322870?
The molecular weight of RefChem:322870 is 306.21 g/mol.
Where can I buy RefChem:322870?
You can request a quote for RefChem:322870 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:322870?
Yes, KEHONG BIO provides custom synthesis services for RefChem:322870 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.