ICI 192605
TL;DR: ICI 192605 (CAS 54016-00-1) is a chemical compound with molecular formula C22H23ClO5 and molecular weight 402.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-6-[(2S,4S,5R)-2-(2-chlorophenyl)-4-(2-hydroxyphenyl)-1,3-dioxan-5-yl]hex-4-enoic acid
Also Known As: ICI 192605, ICI 192,605, BRD-K59433843-001-01-7, (Z)-6-[(2S,4S,5R)-2-(2-chlorophenyl)-4-(2-hydroxyphenyl)-1,3-dioxan-5-yl]hex-4-enoic acid, 4-Bromo-6,7-dihydro-dipyrido[1,2-a:2',1'-c]pyrazinediium Dibromide
| Molecular Formula | C22H23ClO5 |
|---|---|
| Molecular Weight | 402.12 g/mol |
| LogP | 5.2596 |
| Topological Polar Surface Area | 75.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 402.1234 |
| Heavy Atoms | 28 |
| Complexity | 835.18176 |
Chemical Identifiers
| CAS Number | 54016-00-1 |
|---|---|
| SMILES | C1[C@H]([C@H](O[C@H](O1)C2=CC=CC=C2Cl)C3=CC=CC=C3O)C/C=C\CCC(=O)O |
Product Overview
ICI 192605 (CAS 54016-00-1), with molecular formula C22H23ClO5 and molecular weight 402.12 g/mol. IUPAC: (Z)-6-[(2S,4S,5R)-2-(2-chlorophenyl)-4-(2-hydroxyphenyl)-1,3-dioxan-5-yl]hex-4-enoic acid.
Chemical Property Profile of ICI 192605
Property Insights of ICI 192605
The XLogP value of 5.2596 indicates that ICI 192605 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.99 Ų falls within the moderate polarity range, balancing permeability and solubility for ICI 192605. Following Lipinski's Rule of Five, ICI 192605 has 2 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 ICI 192605?
The CAS number of ICI 192605 is 54016-00-1.
What is the molecular formula of ICI 192605?
The molecular formula of ICI 192605 is C22H23ClO5.
What is the molecular weight of ICI 192605?
The molecular weight of ICI 192605 is 402.12 g/mol.
Where can I buy ICI 192605?
You can request a quote for ICI 192605 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ICI 192605?
Yes, KEHONG BIO provides custom synthesis services for ICI 192605 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.