A4122/0175787
TL;DR: A4122/0175787 (CAS 879600-08-5) is a chemical compound with molecular formula C21H22N4O2 and molecular weight 362.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-propyl-4-pyridin-3-yl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Also Known As: A4122/0175787, ethyl 2-propyl-4-(3-pyridyl)-1,4-dihydropyrimido[1,2-a][1,3]benzimidazole-3-carboxylate, ethyl 2-propyl-4-(pyridin-3-yl)-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate, ethyl 2-propyl-4-pyridin-3-yl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate, ethyl 2-propyl-4-(pyridin-3-yl)-1,4-dihydrobenzo[4,5]imidazo[1,2-a]pyrimidine-3-carboxylate
| Molecular Formula | C21H22N4O2 |
|---|---|
| Molecular Weight | 362.17 g/mol |
| LogP | 4.0635 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 362.1743 |
| Heavy Atoms | 27 |
| Complexity | 1007.4533 |
Chemical Identifiers
| CAS Number | 879600-08-5 |
|---|---|
| SMILES | CCCC1=C(C(N2C3=CC=CC=C3N=C2N1)C4=CN=CC=C4)C(=O)OCC |
Product Overview
A4122/0175787 (CAS 879600-08-5), with molecular formula C21H22N4O2 and molecular weight 362.17 g/mol. IUPAC: ethyl 2-propyl-4-pyridin-3-yl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate.
Chemical Property Profile of A4122/0175787
Property Insights of A4122/0175787
The XLogP value of 4.0635 indicates that A4122/0175787 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for A4122/0175787. Following Lipinski's Rule of Five, A4122/0175787 has 1 hydrogen bond donor(s) and 5 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 A4122/0175787?
The CAS number of A4122/0175787 is 879600-08-5.
What is the molecular formula of A4122/0175787?
The molecular formula of A4122/0175787 is C21H22N4O2.
What is the molecular weight of A4122/0175787?
The molecular weight of A4122/0175787 is 362.17 g/mol.
Where can I buy A4122/0175787?
You can request a quote for A4122/0175787 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A4122/0175787?
Yes, KEHONG BIO provides custom synthesis services for A4122/0175787 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.