C25H22FN5O2
TL;DR: C25H22FN5O2 (CAS 848690-25-5) is a chemical compound with molecular formula C25H22FN5O2 and molecular weight 443.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-cyano-11-methyl-2-oxo-7-pentyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene)-3-fluorobenzamide
Also Known As: AO-022/43452728, (E)-N-(3-cyano-10-methyl-5-oxo-1-pentyl-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-fluorobenzamide, N-(5-Cyano-11-methyl-2-oxo-7-pentyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene)-3-fluorobenzamide, N-(3-cyano-10-methyl-5-oxo-1-pentyl-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidin-2-ylidene)-3-fluorobenzamide, N-[(2E)-3-cyano-10-methyl-5-oxo-1-pentyl-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-2-ylidene]-3-fluorobenzamide
| Molecular Formula | C25H22FN5O2 |
|---|---|
| Molecular Weight | 443.18 g/mol |
| LogP | 3.8997 |
| Topological Polar Surface Area | 92.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 443.17575 |
| Heavy Atoms | 33 |
| Complexity | 1559.8912 |
Chemical Identifiers
| CAS Number | 848690-25-5 |
|---|---|
| SMILES | CCCCCN1C2=C(C=C(C1=NC(=O)C3=CC(=CC=C3)F)C#N)C(=O)N4C=CC=C(C4=N2)C |
Product Overview
C25H22FN5O2 (CAS 848690-25-5), with molecular formula C25H22FN5O2 and molecular weight 443.18 g/mol. IUPAC: N-(5-cyano-11-methyl-2-oxo-7-pentyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene)-3-fluorobenzamide.
Chemical Property Profile of C25H22FN5O2
Property Insights of C25H22FN5O2
The XLogP value of 3.8997 indicates that C25H22FN5O2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.52 Ų falls within the moderate polarity range, balancing permeability and solubility for C25H22FN5O2. Following Lipinski's Rule of Five, C25H22FN5O2 has 0 hydrogen bond donor(s) and 4 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 C25H22FN5O2?
The CAS number of C25H22FN5O2 is 848690-25-5.
What is the molecular formula of C25H22FN5O2?
The molecular formula of C25H22FN5O2 is C25H22FN5O2.
What is the molecular weight of C25H22FN5O2?
The molecular weight of C25H22FN5O2 is 443.18 g/mol.
Where can I buy C25H22FN5O2?
You can request a quote for C25H22FN5O2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C25H22FN5O2?
Yes, KEHONG BIO provides custom synthesis services for C25H22FN5O2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.