2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine
TL;DR: 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine (CAS 294892-86-7) is a chemical compound with molecular formula C15H10F4N2S and molecular weight 326.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,1,2,2-tetrafluoroethyl)-2-thiophen-2-yl-3H-1,5-benzodiazepine
Also Known As: ChemDiv1_022224, 2-(1,1,2,2-tetrafluoroethyl)-4-(2-thienyl)-3H-1,5-benzodiazepine, 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine, 2-[4-(1,1,2,2-tetrafluoroethyl)-3H-benzo[b]1,4-diazepin-2-yl]thiophene, 4-(1,1,2,2-tetrafluoroethyl)-2-thiophen-2-yl-3H-1,5-benzodiazepine
| Molecular Formula | C15H10F4N2S |
|---|---|
| Molecular Weight | 326.05 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.05008 |
| Heavy Atoms | 22 |
| Complexity | 478.0 |
Chemical Identifiers
| CAS Number | 294892-86-7 |
|---|---|
| SMILES | C1C(=NC2=CC=CC=C2N=C1C(C(F)F)(F)F)C3=CC=CS3 |
| InChIKey | SMQJGEOOOMKPJL-UHFFFAOYSA-N |
Product Overview
2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine (CAS 294892-86-7), with molecular formula C15H10F4N2S and molecular weight 326.05 g/mol. IUPAC: 4-(1,1,2,2-tetrafluoroethyl)-2-thiophen-2-yl-3H-1,5-benzodiazepine.
Chemical Property Profile of 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine
Property Insights of 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine
The XLogP value of 4.5 indicates that 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.0 Ų, 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine has 0 hydrogen bond donor(s) and 7 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 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine?
The CAS number of 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine is 294892-86-7.
What is the molecular formula of 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine?
The molecular formula of 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine is C15H10F4N2S.
What is the molecular weight of 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine?
The molecular weight of 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine is 326.05 g/mol.
Where can I buy 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine?
You can request a quote for 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,1,2,2-tetrafluoroethyl)-4-(thiophen-2-yl)-3H-1,5-benzodiazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.