2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one
TL;DR: 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one (CAS 109722-50-1) is a chemical compound with molecular formula C16H11N3O and molecular weight 261.0902 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-phenyl-3H-pyrimido[1,2-a]benzimidazol-4-one
Also Known As: 2-phenylpyrimido(1,2-a)benzimidazol-4(3h)-one, 2-phenylpyrimido[1,2-a]benzimidazol-4(3H)-one, 2-phenyl-3H-pyrimido[1,2-a]benzimidazol-4-one, 2-Phenylbenzo[4,5]imidazo[1,2-a]pyrimidin-4(3H)-one, 11-phenyl-1,8,10-triazatricyclo[7.4.0.0^{2,7}]trideca-2(7),3,5,8,10-pentaen-13-one
Technical Specifications
| Molecular Formula | C16H11N3O |
| Molecular Weight | 261.0902 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 47.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 261.0902 Da |
| Heavy Atoms | 20 |
| Complexity | 427.0 |
| SMILES | C1C(=NC2=NC3=CC=CC=C3N2C1=O)C4=CC=CC=C4 |
| InChIKey | XJEYTOUHAUHFKJ-UHFFFAOYSA-N |
Chemical Property Profile of 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one
Property Insights of 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one
The XLogP value of 3.0 indicates that 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.3 Ų, 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one?
The CAS number of 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one is 109722-50-1.
What is the molecular formula of 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one?
The molecular formula of 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one is C16H11N3O.
What is the molecular weight of 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one?
The molecular weight of 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one is 261.0902 g/mol.
Where can I buy 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one?
You can request a quote for 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one?
Yes, CoreyChem provides custom synthesis services for 2-Phenylpyrimido(1,2-A)benzimidazol-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.