2T-0841
TL;DR: 2T-0841 (CAS 861209-60-1) is a chemical compound with molecular formula C23H16F4N4S and molecular weight 456.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(2,5-dimethylpyrrol-1-yl)thiophen-2-yl]-5-(4-fluorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
Also Known As: 2T-0841, 2-[3-(2,5-dimethyl-1H-pyrrol-1-yl)-2-thienyl]-5-(4-fluorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine, 1-{2-[5-(4-fluorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]thiophen-3-yl}-2,5-dimethyl-1H-pyrrole, 2-[3-(2,5-dimethylpyrrol-1-yl)thiophen-2-yl]-5-(4-fluorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
| Molecular Formula | C23H16F4N4S |
|---|---|
| Molecular Weight | 456.10 g/mol |
| LogP | 6.69024 |
| Topological Polar Surface Area | 35.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 456.10318 |
| Heavy Atoms | 32 |
| Complexity | 1421.9688 |
Chemical Identifiers
| CAS Number | 861209-60-1 |
|---|---|
| SMILES | CC1=CC=C(N1C2=C(SC=C2)C3=NN4C(=CC(=NC4=C3)C5=CC=C(C=C5)F)C(F)(F)F)C |
Product Overview
2T-0841 (CAS 861209-60-1), with molecular formula C23H16F4N4S and molecular weight 456.10 g/mol. IUPAC: 2-[3-(2,5-dimethylpyrrol-1-yl)thiophen-2-yl]-5-(4-fluorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine.
Chemical Property Profile of 2T-0841
Property Insights of 2T-0841
The XLogP value of 6.69024 indicates that 2T-0841 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.12 Ų, 2T-0841 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2T-0841 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2T-0841?
The CAS number of 2T-0841 is 861209-60-1.
What is the molecular formula of 2T-0841?
The molecular formula of 2T-0841 is C23H16F4N4S.
What is the molecular weight of 2T-0841?
The molecular weight of 2T-0841 is 456.10 g/mol.
Where can I buy 2T-0841?
You can request a quote for 2T-0841 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2T-0841?
Yes, KEHONG BIO provides custom synthesis services for 2T-0841 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.