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2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile
TL;DR: 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile (CAS 303059-26-9) is a chemical compound with molecular formula C18H13N5 and molecular weight 299.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile
Also Known As: 2-(benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile, AE-641/10660033, 2-(benzylamino)pyrimido(1,2-a)benzimidazole-3-carbonitrile, 2-(Benzylamino)benzo[4,5]imidazo[1,2-a]pyrimidine-3-carbonitrile, 11-(benzylamino)-1,8,10-triazatricyclo[7.4.0.0^{2,7}]trideca-2(7),3,5,8,10,12-hexaene-12-carbonitrile
| Molecular Formula | C18H13N5 |
|---|---|
| Molecular Weight | 299.12 g/mol |
| LogP | 3.36628 |
| Topological Polar Surface Area | 66.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.1171 |
| Heavy Atoms | 23 |
| Complexity | 1027.8379 |
Chemical Identifiers
| CAS Number | 303059-26-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC2=NC3=NC4=CC=CC=C4N3C=C2C#N |
Product Overview
2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile (CAS 303059-26-9), with molecular formula C18H13N5 and molecular weight 299.12 g/mol. IUPAC: 2-(benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile.
Chemical Property Profile of 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile
Property Insights of 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile
The XLogP value of 3.36628 indicates that 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile. Following Lipinski's Rule of Five, 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile has 1 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 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile?
The CAS number of 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile is 303059-26-9.
What is the molecular formula of 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile?
The molecular formula of 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile is C18H13N5.
What is the molecular weight of 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile?
The molecular weight of 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile is 299.12 g/mol.
Where can I buy 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile?
You can request a quote for 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(Benzylamino)pyrimido[1,2-a]benzimidazole-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.