WH48
TL;DR: WH48 (CAS 90103-48-3) is a chemical compound with molecular formula C22H26O2S and molecular weight 354.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-2-(4,4,7,7-tetramethyl-5,6-dihydro-1-benzothiophen-2-yl)prop-1-enyl]benzoic acid
Also Known As: WH48, WH 48, (E)-4-(2-(4,5,6,7-Tetrahydro-4,4,7,7-tetramethylbenzo(b)thien-2-yl)-1-propenyl)benzoic acid, 4(2-(4,5,6,7-tetrahydro-4,4,7,7,-tetramethylbenzo(b)thien-2-yl)-1-propenyl) benzoic acid, Benzoic acid, 4-(2-(4,5,6,7-tetrahydro-4,4,7,7-tetramethylbenzo(b)thien-2-yl)-1-propenyl)-, (E)-
| Molecular Formula | C22H26O2S |
|---|---|
| Molecular Weight | 354.17 g/mol |
| LogP | 6.3558 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 354.16534 |
| Heavy Atoms | 25 |
| Complexity | 801.91223 |
Chemical Identifiers
| CAS Number | 90103-48-3 |
|---|---|
| SMILES | C/C(=C\C1=CC=C(C=C1)C(=O)O)/C2=CC3=C(S2)C(CCC3(C)C)(C)C |
Product Overview
WH48 (CAS 90103-48-3), with molecular formula C22H26O2S and molecular weight 354.17 g/mol. IUPAC: 4-[(E)-2-(4,4,7,7-tetramethyl-5,6-dihydro-1-benzothiophen-2-yl)prop-1-enyl]benzoic acid.
Chemical Property Profile of WH48
Property Insights of WH48
The XLogP value of 6.3558 indicates that WH48 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, WH48 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, WH48 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 WH48?
The CAS number of WH48 is 90103-48-3.
What is the molecular formula of WH48?
The molecular formula of WH48 is C22H26O2S.
What is the molecular weight of WH48?
The molecular weight of WH48 is 354.17 g/mol.
Where can I buy WH48?
You can request a quote for WH48 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for WH48?
Yes, KEHONG BIO provides custom synthesis services for WH48 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.