2T-0895
TL;DR: 2T-0895 (CAS 956779-56-9) is a chemical compound with molecular formula C22H16F3N3O2S and molecular weight 443.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]-5-(trifluoromethyl)pyrazole-4-carboxylate
Also Known As: 2T-0895, Ethyl 1-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]-5-(trifluoromethyl)pyrazole-4-carboxylate, ethyl 1-(4-[1,1'-biphenyl]-4-yl-1,3-thiazol-2-yl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylate, ethyl 1-(4-{[1,1'-biphenyl]-4-yl}-1,3-thiazol-2-yl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylate, ethyl 1-(4-{[1,1'-biphenyl]-4-yl}-1,3-thiazol-2-yl)-5-(trifluoromethyl)pyrazole-4-carboxylate
| Molecular Formula | C22H16F3N3O2S |
|---|---|
| Molecular Weight | 443.09 g/mol |
| LogP | 5.8583 |
| Topological Polar Surface Area | 57.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 443.09152 |
| Heavy Atoms | 31 |
| Complexity | 1198.9766 |
Chemical Identifiers
| CAS Number | 956779-56-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(N=C1)C2=NC(=CS2)C3=CC=C(C=C3)C4=CC=CC=C4)C(F)(F)F |
Product Overview
2T-0895 (CAS 956779-56-9), with molecular formula C22H16F3N3O2S and molecular weight 443.09 g/mol. IUPAC: ethyl 1-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]-5-(trifluoromethyl)pyrazole-4-carboxylate.
Chemical Property Profile of 2T-0895
Property Insights of 2T-0895
The XLogP value of 5.8583 indicates that 2T-0895 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.01 Ų, 2T-0895 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2T-0895 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 2T-0895?
The CAS number of 2T-0895 is 956779-56-9.
What is the molecular formula of 2T-0895?
The molecular formula of 2T-0895 is C22H16F3N3O2S.
What is the molecular weight of 2T-0895?
The molecular weight of 2T-0895 is 443.09 g/mol.
Where can I buy 2T-0895?
You can request a quote for 2T-0895 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2T-0895?
Yes, KEHONG BIO provides custom synthesis services for 2T-0895 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.