5-Thiazoleethanol, 4-methyl-, picrate
TL;DR: 5-Thiazoleethanol, 4-methyl-, picrate (CAS 5985-20-6) is a chemical compound with molecular formula C30H29FN4O3 and molecular weight 512.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)pyrazol-5-yl]methanone
Also Known As: 5-Thiazoleethanol, 4-methyl-, picrate, {4-[(2H-1,3-Benzodioxol-5-yl)methyl]piperazin-1-yl}[1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazol-5-yl]methanone, 5-Thiazoleethanol, 4-methyl-, compd. with 2,4,6-trinitrophenol (1:1), [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[2-(2,4-dimethylphenyl)-5-(4-fluorophenyl)pyrazol-3-yl]methanone
| Molecular Formula | C30H29FN4O3 |
|---|---|
| Molecular Weight | 512.22 g/mol |
| LogP | 4.98194 |
| Topological Polar Surface Area | 59.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 512.22235 |
| Heavy Atoms | 38 |
| Complexity | 1490.1263 |
Chemical Identifiers
| CAS Number | 5985-20-6 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=C(C=C3)F)C(=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6)C |
Product Overview
5-Thiazoleethanol, 4-methyl-, picrate (CAS 5985-20-6), with molecular formula C30H29FN4O3 and molecular weight 512.22 g/mol. IUPAC: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)pyrazol-5-yl]methanone.
Chemical Property Profile of 5-Thiazoleethanol, 4-methyl-, picrate
Property Insights of 5-Thiazoleethanol, 4-methyl-, picrate
The XLogP value of 4.98194 indicates that 5-Thiazoleethanol, 4-methyl-, picrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.83 Ų, 5-Thiazoleethanol, 4-methyl-, picrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Thiazoleethanol, 4-methyl-, picrate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Thiazoleethanol, 4-methyl-, picrate?
The CAS number of 5-Thiazoleethanol, 4-methyl-, picrate is 5985-20-6.
What is the molecular formula of 5-Thiazoleethanol, 4-methyl-, picrate?
The molecular formula of 5-Thiazoleethanol, 4-methyl-, picrate is C30H29FN4O3.
What is the molecular weight of 5-Thiazoleethanol, 4-methyl-, picrate?
The molecular weight of 5-Thiazoleethanol, 4-methyl-, picrate is 512.22 g/mol.
Where can I buy 5-Thiazoleethanol, 4-methyl-, picrate?
You can request a quote for 5-Thiazoleethanol, 4-methyl-, picrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Thiazoleethanol, 4-methyl-, picrate?
Yes, KEHONG BIO provides custom synthesis services for 5-Thiazoleethanol, 4-methyl-, picrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.