4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde
TL;DR: 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde (CAS 85656-57-1) is a chemical compound with molecular formula C15H18N2OS and molecular weight 274.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-2-(N-methylanilino)-1,3-thiazole-5-carbaldehyde
Also Known As: 4-(tert-Butyl)-2-(methyl(phenyl)amino)thiazole-5-carbaldehyde, 4-tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde, AB-601/30968048, 4-tert-butyl-2-(N-methylanilino)-1,3-thiazole-5-carbaldehyde
| Molecular Formula | C15H18N2OS |
|---|---|
| Molecular Weight | 274.11 g/mol |
| LogP | 4.021 |
| Topological Polar Surface Area | 33.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.11398 |
| Heavy Atoms | 19 |
| Complexity | 569.57666 |
Chemical Identifiers
| CAS Number | 85656-57-1 |
|---|---|
| SMILES | CC(C)(C)C1=C(SC(=N1)N(C)C2=CC=CC=C2)C=O |
Product Overview
4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde (CAS 85656-57-1), with molecular formula C15H18N2OS and molecular weight 274.11 g/mol. IUPAC: 4-tert-butyl-2-(N-methylanilino)-1,3-thiazole-5-carbaldehyde.
Chemical Property Profile of 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde
Property Insights of 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde
The XLogP value of 4.021 indicates that 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.2 Ų, 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde has 0 hydrogen bond donor(s) and 4 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 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde?
The CAS number of 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde is 85656-57-1.
What is the molecular formula of 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde?
The molecular formula of 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde is C15H18N2OS.
What is the molecular weight of 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde?
The molecular weight of 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde is 274.11 g/mol.
Where can I buy 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde?
You can request a quote for 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-Tert-butyl-2-(methylanilino)-1,3-thiazole-5-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.