![2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide structure](/static/products/6031/6031-56-7.webp)
2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide
TL;DR: 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide (CAS 6031-56-7) is a chemical compound with molecular formula C30H29F4N3OS and molecular weight 555.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(4-tert-butylphenyl)methyl-[[3-(trifluoromethyl)phenyl]methyl]amino]methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide
Also Known As: 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide, 2-[[(4-tert-butylphenyl)methyl-[[3-(trifluoromethyl)phenyl]methyl]amino]methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide
| Molecular Formula | C30H29F4N3OS |
|---|---|
| Molecular Weight | 555.20 g/mol |
| LogP | 8.0532 |
| Topological Polar Surface Area | 45.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 555.1967 |
| Heavy Atoms | 39 |
| Complexity | 1425.1458 |
Chemical Identifiers
| CAS Number | 6031-56-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC(=CC=C2)C(F)(F)F)CC3=NC(=CS3)C(=O)NC4=CC=CC=C4F |
Product Overview
2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide (CAS 6031-56-7), with molecular formula C30H29F4N3OS and molecular weight 555.20 g/mol. IUPAC: 2-[[(4-tert-butylphenyl)methyl-[[3-(trifluoromethyl)phenyl]methyl]amino]methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide.
Chemical Property Profile of 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide
Property Insights of 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide
The XLogP value of 8.0532 indicates that 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.23 Ų, 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide has 1 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 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide?
The CAS number of 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide is 6031-56-7.
What is the molecular formula of 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide?
The molecular formula of 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide is C30H29F4N3OS.
What is the molecular weight of 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide?
The molecular weight of 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide is 555.20 g/mol.
Where can I buy 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide?
You can request a quote for 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[([(4-tert-Butylphenyl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.