RefChem:349051
TL;DR: RefChem:349051 (CAS 1535-05-3) is a chemical compound with molecular formula C20H21ClF3N and molecular weight 367.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]-3H-inden-1-yl]ethanamine;hydrochloride
Also Known As: Indene-3-ethylamine, N,N-dimethyl-2-(alpha,alpha,alpha-trifluoro-p-tolyl)-, hydrochloride, N,N-Dimethyl-2-(alpha,alpha,alpha-trifluoro-p-tolyl)-indene-3-ethylamine hydrochloride, N,N-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]-3H-inden-1-yl]ethanamine hydrochloride, N,N-Dimethyl-2-{2-[4-(trifluoromethyl)phenyl]-1H-inden-3-yl}ethan-1-amine--hydrogen chloride (1/1), RefChem:349051
| Molecular Formula | C20H21ClF3N |
|---|---|
| Molecular Weight | 367.13 g/mol |
| LogP | 5.5458 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.13147 |
| Heavy Atoms | 25 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 1535-05-3 |
|---|---|
| SMILES | CN(C)CCC1=C(CC2=CC=CC=C21)C3=CC=C(C=C3)C(F)(F)F.Cl |
| InChIKey | RNPSXIWZRJCQCX-UHFFFAOYSA-N |
Product Overview
RefChem:349051 (CAS 1535-05-3), with molecular formula C20H21ClF3N and molecular weight 367.13 g/mol. IUPAC: N,N-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]-3H-inden-1-yl]ethanamine;hydrochloride.
Chemical Property Profile of RefChem:349051
Property Insights of RefChem:349051
The XLogP value of 5.5458 indicates that RefChem:349051 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, RefChem:349051 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:349051 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:349051?
The CAS number of RefChem:349051 is 1535-05-3.
What is the molecular formula of RefChem:349051?
The molecular formula of RefChem:349051 is C20H21ClF3N.
What is the molecular weight of RefChem:349051?
The molecular weight of RefChem:349051 is 367.13 g/mol.
Where can I buy RefChem:349051?
You can request a quote for RefChem:349051 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:349051?
Yes, KEHONG BIO provides custom synthesis services for RefChem:349051 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.