Indralin
TL;DR: Indralin (CAS 156691-86-0) is a chemical compound with molecular formula C23H28O2S and molecular weight 368.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(E)-2-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)prop-1-enyl]thiophene-2-carboxylic acid
Also Known As: Indralin, INDRALINE, Agn 191659, (E)-5-(2-(5,6,7,8-Tetrahydro-3,5,5,8,8-pentamethyl-2-naphthyl)propen-1-yl)-2-thiophenecarboxylic acid, 5-[(E)-2-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)prop-1-enyl]thiophene-2-carboxylic acid
| Molecular Formula | C23H28O2S |
|---|---|
| Molecular Weight | 368.18 g/mol |
| LogP | 6.66422 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 368.181 |
| Heavy Atoms | 26 |
| Complexity | 896.9268 |
Chemical Identifiers
| CAS Number | 156691-86-0 |
|---|---|
| SMILES | CC1=CC2=C(C=C1/C(=C/C3=CC=C(S3)C(=O)O)/C)C(CCC2(C)C)(C)C |
Product Overview
Indralin (CAS 156691-86-0), with molecular formula C23H28O2S and molecular weight 368.18 g/mol. IUPAC: 5-[(E)-2-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)prop-1-enyl]thiophene-2-carboxylic acid.
Chemical Property Profile of Indralin
Property Insights of Indralin
The XLogP value of 6.66422 indicates that Indralin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Indralin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indralin has 1 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 Indralin?
The CAS number of Indralin is 156691-86-0.
What is the molecular formula of Indralin?
The molecular formula of Indralin is C23H28O2S.
What is the molecular weight of Indralin?
The molecular weight of Indralin is 368.18 g/mol.
Where can I buy Indralin?
You can request a quote for Indralin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indralin?
Yes, KEHONG BIO provides custom synthesis services for Indralin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.