C25H17ClN4O4
TL;DR: C25H17ClN4O4 (CAS 620107-31-5) is a chemical compound with molecular formula C25H17ClN4O4 and molecular weight 472.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[2-(2-chlorophenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-(4-methoxyphenyl)prop-2-enamide
Also Known As: (2E)-3-[2-(2-chlorophenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-(4-methoxyphenyl)prop-2-enamide, (E)-3-(2-(2-chlorophenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-(4-methoxyphenyl)acrylamide, (E)-3-[2-(2-chlorophenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-(4-methoxyphenyl)prop-2-enamide
| Molecular Formula | C25H17ClN4O4 |
|---|---|
| Molecular Weight | 472.09 g/mol |
| LogP | 4.69448 |
| Topological Polar Surface Area | 105.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 472.09384 |
| Heavy Atoms | 34 |
| Complexity | 1504.3774 |
Chemical Identifiers
| CAS Number | 620107-31-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)/C(=C/C2=C(N=C3C=CC=CN3C2=O)OC4=CC=CC=C4Cl)/C#N |
Product Overview
C25H17ClN4O4 (CAS 620107-31-5), with molecular formula C25H17ClN4O4 and molecular weight 472.09 g/mol. IUPAC: (E)-3-[2-(2-chlorophenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-(4-methoxyphenyl)prop-2-enamide.
Chemical Property Profile of C25H17ClN4O4
Property Insights of C25H17ClN4O4
The XLogP value of 4.69448 indicates that C25H17ClN4O4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.72 Ų falls within the moderate polarity range, balancing permeability and solubility for C25H17ClN4O4. Following Lipinski's Rule of Five, C25H17ClN4O4 has 1 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 C25H17ClN4O4?
The CAS number of C25H17ClN4O4 is 620107-31-5.
What is the molecular formula of C25H17ClN4O4?
The molecular formula of C25H17ClN4O4 is C25H17ClN4O4.
What is the molecular weight of C25H17ClN4O4?
The molecular weight of C25H17ClN4O4 is 472.09 g/mol.
Where can I buy C25H17ClN4O4?
You can request a quote for C25H17ClN4O4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C25H17ClN4O4?
Yes, KEHONG BIO provides custom synthesis services for C25H17ClN4O4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.