4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide
TL;DR: 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide (CAS 116477-73-7) is a chemical compound with molecular formula C23H21N5O3 and molecular weight 415.16443 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-butoxy-N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-3-methoxybenzamide
Also Known As: 4-butoxy-N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-3-methoxybenzamide, AE-641/40198024, 4-BUTOXY-N-(3-CYANOPYRIMIDO(1,2-A)BENZIMIDAZOL-2-YL)-3-METHOXYBENZAMIDE, 4-Butoxy-N-(3-cyanobenzo[4,5]imidazo[1,2-a]pyrimidin-2-yl)-3-methoxybenzamide, 663-554-8
Technical Specifications
| Molecular Formula | C23H21N5O3 |
| Molecular Weight | 415.16443 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 415.16443 Da |
| Heavy Atoms | 31 |
| Complexity | 667.0 |
| SMILES | CCCCOC1=C(C=C(C=C1)C(=O)NC2=NC3=NC4=CC=CC=C4N3C=C2C#N)OC |
| InChIKey | TXUXUFPNOIVSMR-UHFFFAOYSA-N |
Chemical Property Profile of 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide
Property Insights of 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide
The XLogP value of 5.2 indicates that 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide. Following Lipinski's Rule of Five, 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide?
The CAS number of 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide is 116477-73-7.
What is the molecular formula of 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide?
The molecular formula of 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide is C23H21N5O3.
What is the molecular weight of 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide?
The molecular weight of 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide is 415.16443 g/mol.
Where can I buy 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide?
You can request a quote for 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide?
Yes, CoreyChem provides custom synthesis services for 4-Butoxy-N-(3-cyanopyrimido(1,2-A)benzimidazol-2-YL)-3-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.