(Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide
TL;DR: (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide (CAS 1164510-77-3) is a chemical compound with molecular formula C27H24N4O5 and molecular weight 484.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide
Also Known As: (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide, N-[(1Z)-3-{[2-(1H-benzimidazol-2-yl)ethyl]amino}-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide, N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide, N-{(Z)-2-Benzo[1,3]dioxol-5-yl-1-[2-(1H-benzoimidazol-2-yl)-ethylcarbamoyl]-vinyl}-2-methoxy-benzamide
| Molecular Formula | C27H24N4O5 |
|---|---|
| Molecular Weight | 484.17 g/mol |
| LogP | 3.43 |
| Topological Polar Surface Area | 114.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 484.17468 |
| Heavy Atoms | 36 |
| Complexity | 1426.5886 |
Chemical Identifiers
| CAS Number | 1164510-77-3 |
|---|---|
| SMILES | COC1=CC=CC=C1C(=O)N/C(=C\C2=CC3=C(C=C2)OCO3)/C(=O)NCCC4=NC5=CC=CC=C5N4 |
Product Overview
(Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide (CAS 1164510-77-3), with molecular formula C27H24N4O5 and molecular weight 484.17 g/mol. IUPAC: N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide.
Chemical Property Profile of (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide
Property Insights of (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide
The XLogP value of 3.43 indicates that (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.57 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide. Following Lipinski's Rule of Five, (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide has 3 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 (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide?
The CAS number of (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide is 1164510-77-3.
What is the molecular formula of (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide?
The molecular formula of (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide is C27H24N4O5.
What is the molecular weight of (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide?
The molecular weight of (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide is 484.17 g/mol.
Where can I buy (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide?
You can request a quote for (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-2-yl)-2-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.