Ici 42464
TL;DR: Ici 42464 (CAS 20794-96-1) is a chemical compound with molecular formula C15H19Cl2N and molecular weight 283.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloro-2-naphthalen-2-ylethyl)-propan-2-ylazanium chloride
Also Known As: Ici 42464, beta-Chloro-N-isopropyl-2-naphthaleneethanamine hydrochloride, beta-Chloro-N-isopropyl-2-naphthaleneethylamine hydrochloride, (2-chloro-2-naphthalen-2-ylethyl)-propan-2-ylazanium chloride, 2-(alpha-Chloro-beta-isopropylamine)ethylnaphthalene hydrochloride
| Molecular Formula | C15H19Cl2N |
|---|---|
| Molecular Weight | 283.09 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 16.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.08945 |
| Heavy Atoms | 18 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 20794-96-1 |
|---|---|
| SMILES | CC(C)[NH2+]CC(C1=CC2=CC=CC=C2C=C1)Cl.[Cl-] |
| InChIKey | JZZLKKRCFFAJGF-UHFFFAOYSA-N |
Product Overview
Ici 42464 (CAS 20794-96-1), with molecular formula C15H19Cl2N and molecular weight 283.09 g/mol. IUPAC: (2-chloro-2-naphthalen-2-ylethyl)-propan-2-ylazanium chloride.
Chemical Property Profile of Ici 42464
Property Insights of Ici 42464
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ici 42464. With a topological polar surface area (TPSA) of 16.6 Ų, Ici 42464 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ici 42464 has 1 hydrogen bond donor(s) and 1 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 Ici 42464?
The CAS number of Ici 42464 is 20794-96-1.
What is the molecular formula of Ici 42464?
The molecular formula of Ici 42464 is C15H19Cl2N.
What is the molecular weight of Ici 42464?
The molecular weight of Ici 42464 is 283.09 g/mol.
Where can I buy Ici 42464?
You can request a quote for Ici 42464 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ici 42464?
Yes, KEHONG BIO provides custom synthesis services for Ici 42464 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.