RefChem:296824
TL;DR: RefChem:296824 (CAS 77796-15-7) is a chemical compound with molecular formula C22H16F2N4 and molecular weight 374.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-fluoro-6-(4-fluorophenyl)-1-pyridin-3-yl-5,6-dihydro-4H-[1,2,4]triazolo[4,3-a][1]benzazepine
Also Known As: 4H-(1,2,4)Triazolo(4,3-a)(1)benzazepine, 5,6-dihydro-9-fluoro-6-(4-fluorophenyl)-1-(3-pyridinyl)-, AE-641/30153059, 9-fluoro-6-(4-fluorophenyl)-1-pyridin-3-yl-5,6-dihydro-4H-[1,2,4]triazolo[4,3-a][1]benzazepine, 9-fluoro-6-(4-fluorophenyl)-1-(3-pyridinyl)-5,6-dihydro-4H-[1,2,4]triazolo[4,3-a][1]benzazepine, 9-Fluoro-6-(4-fluorophenyl)-1-(pyridin-3-yl)-5,6-dihydro-4H-[1,2,4]triazolo[4,3-a][1]benzazepine
| Molecular Formula | C22H16F2N4 |
|---|---|
| Molecular Weight | 374.13 g/mol |
| LogP | 4.6856 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 374.1343 |
| Heavy Atoms | 28 |
| Complexity | 1137.1779 |
Chemical Identifiers
| CAS Number | 77796-15-7 |
|---|---|
| SMILES | C1CC2=NN=C(N2C3=C(C1C4=CC=C(C=C4)F)C=CC(=C3)F)C5=CN=CC=C5 |
Product Overview
RefChem:296824 (CAS 77796-15-7), with molecular formula C22H16F2N4 and molecular weight 374.13 g/mol. IUPAC: 9-fluoro-6-(4-fluorophenyl)-1-pyridin-3-yl-5,6-dihydro-4H-[1,2,4]triazolo[4,3-a][1]benzazepine.
Chemical Property Profile of RefChem:296824
Property Insights of RefChem:296824
The XLogP value of 4.6856 indicates that RefChem:296824 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.6 Ų, RefChem:296824 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:296824 has 0 hydrogen bond donor(s) and 3 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 RefChem:296824?
The CAS number of RefChem:296824 is 77796-15-7.
What is the molecular formula of RefChem:296824?
The molecular formula of RefChem:296824 is C22H16F2N4.
What is the molecular weight of RefChem:296824?
The molecular weight of RefChem:296824 is 374.13 g/mol.
Where can I buy RefChem:296824?
You can request a quote for RefChem:296824 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:296824?
Yes, KEHONG BIO provides custom synthesis services for RefChem:296824 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.