A2235/0094075
TL;DR: A2235/0094075 (CAS 309730-84-5) is a chemical compound with molecular formula C14H15F6N3O2S and molecular weight 403.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-acetamido-1,1,1,3,3,3-hexafluoropropan-2-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: A2235/0094075, 2-[(2-acetamido-1,1,1,3,3,3-hexafluoropropan-2-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 2-((2-acetamido-1,1,1,3,3,3-hexafluoropropan-2-yl)amino)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide, 2-([1-(Acetylamino)-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide #, 2-{[1-(acetylamino)-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
| Molecular Formula | C14H15F6N3O2S |
|---|---|
| Molecular Weight | 403.08 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.07892 |
| Heavy Atoms | 26 |
| Complexity | 554.0 |
Chemical Identifiers
| CAS Number | 309730-84-5 |
|---|---|
| SMILES | CC(=O)NC(C(F)(F)F)(C(F)(F)F)NC1=C(C2=C(S1)CCCC2)C(=O)N |
| InChIKey | ICVPCUFXHVJHCY-UHFFFAOYSA-N |
Product Overview
A2235/0094075 (CAS 309730-84-5), with molecular formula C14H15F6N3O2S and molecular weight 403.08 g/mol. IUPAC: 2-[(2-acetamido-1,1,1,3,3,3-hexafluoropropan-2-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of A2235/0094075
Property Insights of A2235/0094075
The XLogP value of 4.1 indicates that A2235/0094075 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for A2235/0094075. Following Lipinski's Rule of Five, A2235/0094075 has 3 hydrogen bond donor(s) and 10 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 A2235/0094075?
The CAS number of A2235/0094075 is 309730-84-5.
What is the molecular formula of A2235/0094075?
The molecular formula of A2235/0094075 is C14H15F6N3O2S.
What is the molecular weight of A2235/0094075?
The molecular weight of A2235/0094075 is 403.08 g/mol.
Where can I buy A2235/0094075?
You can request a quote for A2235/0094075 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2235/0094075?
Yes, KEHONG BIO provides custom synthesis services for A2235/0094075 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.