N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide
TL;DR: N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide (CAS 116477-74-8) is a chemical compound with molecular formula C23H21N5O3 and molecular weight 415.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-3-methoxy-4-(2-methylpropoxy)benzamide
Also Known As: N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-4-isobutoxy-3-methoxybenzamide, N-(3-Cyanobenzo[4,5]imidazo[1,2-a]pyrimidin-2-yl)-4-isobutoxy-3-methoxybenzamide, N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide, N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-3-methoxy-4-(2-methylpropoxy)benzamide, 663-550-6
| Molecular Formula | C23H21N5O3 |
|---|---|
| Molecular Weight | 415.16 g/mol |
| LogP | 4.04988 |
| Topological Polar Surface Area | 101.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 415.16443 |
| Heavy Atoms | 31 |
| Complexity | 1320.284 |
Chemical Identifiers
| CAS Number | 116477-74-8 |
|---|---|
| SMILES | CC(C)COC1=C(C=C(C=C1)C(=O)NC2=NC3=NC4=CC=CC=C4N3C=C2C#N)OC |
Product Overview
N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide (CAS 116477-74-8), with molecular formula C23H21N5O3 and molecular weight 415.16 g/mol. IUPAC: N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-3-methoxy-4-(2-methylpropoxy)benzamide.
Chemical Property Profile of N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide
Property Insights of N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide
The XLogP value of 4.04988 indicates that N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.54 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide. Following Lipinski's Rule of Five, N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide has 1 hydrogen bond donor(s) and 6 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 N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide?
The CAS number of N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide is 116477-74-8.
What is the molecular formula of N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide?
The molecular formula of N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide is C23H21N5O3.
What is the molecular weight of N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide?
The molecular weight of N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide is 415.16 g/mol.
Where can I buy N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide?
You can request a quote for N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-Cyanopyrimido(1,2-A)benzimidazol-2-YL)-4-isobutoxy-3-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.