AS 35
TL;DR: AS 35 (CAS 108427-72-1) is a chemical compound with molecular formula C21H20N6O4 and molecular weight 420.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-3-(2H-tetrazol-5-yl)pyrido[1,2-a]pyrimidin-4-one
Also Known As: as35, 4H-Pyrido[1,2-a]pyrimidin-4-one,9-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-3-(2H-tetrazol-5-yl)-, 4H-Pyrido(1,2-a)pyrimidin-4-one, 9-((4-acetyl-3-hydroxy-2-propylphenoxy)methyl)-3-(1H-tetrazol-5-yl)-, 9-((4-Acetyl-3-hydroxy-2-propylphenoxy)methyl)-3-(1H-tetrazol-5-yl)-4H-pyrido(1,2-a)pyrimidin-4-one, 9-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-3-(2H-tetrazol-5-yl)pyrido[1,2-a]pyrimidin-4-one
| Molecular Formula | C21H20N6O4 |
|---|---|
| Molecular Weight | 420.15 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 420.1546 |
| Heavy Atoms | 31 |
| Complexity | 851.0 |
Chemical Identifiers
| CAS Number | 108427-72-1 |
|---|---|
| SMILES | CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC=CN3C2=NC=C(C3=O)C4=NNN=N4 |
| InChIKey | RVRGDCZGEKSIRW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
AS 35 (CAS 108427-72-1), with molecular formula C21H20N6O4 and molecular weight 420.15 g/mol. IUPAC: 9-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-3-(2H-tetrazol-5-yl)pyrido[1,2-a]pyrimidin-4-one.
Chemical Property Profile of AS 35
Property Insights of AS 35
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AS 35. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AS 35. Following Lipinski's Rule of Five, AS 35 has 2 hydrogen bond donor(s) and 8 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 AS 35?
The CAS number of AS 35 is 108427-72-1.
What is the molecular formula of AS 35?
The molecular formula of AS 35 is C21H20N6O4.
What is the molecular weight of AS 35?
The molecular weight of AS 35 is 420.15 g/mol.
Where can I buy AS 35?
You can request a quote for AS 35 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS 35?
Yes, KEHONG BIO provides custom synthesis services for AS 35 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.