ChemDiv1_018290
TL;DR: ChemDiv1_018290 (CAS 442872-61-9) is a chemical compound with molecular formula C24H18N6O2 and molecular weight 422.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-3-[4-(3-cyanopropoxy)-3-methoxyphenyl]pyrido[1,2-a]benzimidazole-2,4-dicarbonitrile
Also Known As: ChemDiv1_018290, 1-amino-3-[4-(3-cyanopropoxy)-3-methoxyphenyl]pyrido[1,2-a]benzimidazole-2,4-dicarbonitrile, AN-465/15279035, A2619/0111394, 1-amino-2-cyano-3-[4-(3-cyanopropoxy)-3-methoxyphenyl]pyrido[1,2-a][1,3]benzimidazol-4-yl cyanide
| Molecular Formula | C24H18N6O2 |
|---|---|
| Molecular Weight | 422.15 g/mol |
| LogP | 4.17124 |
| Topological Polar Surface Area | 133.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 422.1491 |
| Heavy Atoms | 32 |
| Complexity | 1466.8732 |
Chemical Identifiers
| CAS Number | 442872-61-9 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C2=C(C3=NC4=CC=CC=C4N3C(=C2C#N)N)C#N)OCCCC#N |
Product Overview
ChemDiv1_018290 (CAS 442872-61-9), with molecular formula C24H18N6O2 and molecular weight 422.15 g/mol. IUPAC: 1-amino-3-[4-(3-cyanopropoxy)-3-methoxyphenyl]pyrido[1,2-a]benzimidazole-2,4-dicarbonitrile.
Chemical Property Profile of ChemDiv1_018290
Property Insights of ChemDiv1_018290
The XLogP value of 4.17124 indicates that ChemDiv1_018290 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.15 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_018290. Following Lipinski's Rule of Five, ChemDiv1_018290 has 1 hydrogen bond donor(s) and 7 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 ChemDiv1_018290?
The CAS number of ChemDiv1_018290 is 442872-61-9.
What is the molecular formula of ChemDiv1_018290?
The molecular formula of ChemDiv1_018290 is C24H18N6O2.
What is the molecular weight of ChemDiv1_018290?
The molecular weight of ChemDiv1_018290 is 422.15 g/mol.
Where can I buy ChemDiv1_018290?
You can request a quote for ChemDiv1_018290 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_018290?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_018290 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.