F0832-0242
TL;DR: F0832-0242 (CAS 398997-19-8) is a chemical compound with molecular formula C24H22N4O3 and molecular weight 414.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-2-cyano-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)ethenyl]phenyl] 2-methoxybenzoate
Also Known As: F0832-0242, (E)-4-(2-cyano-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)vinyl)phenyl 2-methoxybenzoate, [4-[(E)-2-cyano-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)ethenyl]phenyl] 2-methoxybenzoate, 4-[(1E)-2-cyano-2-{5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-yl}eth-1-en-1-yl]phenyl 2-methoxybenzoate
| Molecular Formula | C24H22N4O3 |
|---|---|
| Molecular Weight | 414.17 g/mol |
| LogP | 4.29648 |
| Topological Polar Surface Area | 90.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.1692 |
| Heavy Atoms | 31 |
| Complexity | 1156.3126 |
Chemical Identifiers
| CAS Number | 398997-19-8 |
|---|---|
| SMILES | COC1=CC=CC=C1C(=O)OC2=CC=C(C=C2)/C=C(\C#N)/C3=NN=C4N3CCCCC4 |
Product Overview
F0832-0242 (CAS 398997-19-8), with molecular formula C24H22N4O3 and molecular weight 414.17 g/mol. IUPAC: [4-[(E)-2-cyano-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)ethenyl]phenyl] 2-methoxybenzoate.
Chemical Property Profile of F0832-0242
Property Insights of F0832-0242
The XLogP value of 4.29648 indicates that F0832-0242 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.03 Ų falls within the moderate polarity range, balancing permeability and solubility for F0832-0242. Following Lipinski's Rule of Five, F0832-0242 has 0 hydrogen bond donor(s) and 6 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 F0832-0242?
The CAS number of F0832-0242 is 398997-19-8.
What is the molecular formula of F0832-0242?
The molecular formula of F0832-0242 is C24H22N4O3.
What is the molecular weight of F0832-0242?
The molecular weight of F0832-0242 is 414.17 g/mol.
Where can I buy F0832-0242?
You can request a quote for F0832-0242 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0832-0242?
Yes, KEHONG BIO provides custom synthesis services for F0832-0242 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.