![(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)-4-isobutoxybenzamide structure](/static/products/846/846579-29-1.png)
(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)-4-isobutoxybenzamide
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)-4-isobutoxybenzamide (CAS 846579-29-1) is a chemical compound with molecular formula C30H30N4O5 and molecular weight 526.22 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]-4-(2-methylpropoxy)benzamide
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)-4-isobutoxybenzamide, N-[(1Z)-3-{[2-(1H-benzimidazol-2-yl)ethyl]amino}-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide, N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide
| Molecular Formula | C30H30N4O5 |
|---|---|
| Molecular Weight | 526.22 g/mol |
| LogP | 4.4562 |
| Topological Polar Surface Area | 114.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 526.2216 |
| Heavy Atoms | 39 |
| Complexity | 1474.5785 |
Chemical Identifiers
| CAS Number | 846579-29-1 |
|---|---|
| SMILES | CC(C)COC1=CC=C(C=C1)C(=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)-4-isobutoxybenzamide (CAS 846579-29-1), with molecular formula C30H30N4O5 and molecular weight 526.22 g/mol. IUPAC: N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide.
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)-4-isobutoxybenzamide
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)-4-isobutoxybenzamide
The XLogP value of 4.4562 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)-4-isobutoxybenzamide 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)-4-isobutoxybenzamide. 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)-4-isobutoxybenzamide has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
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)-4-isobutoxybenzamide?
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)-4-isobutoxybenzamide is 846579-29-1.
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)-4-isobutoxybenzamide?
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)-4-isobutoxybenzamide is C30H30N4O5.
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)-4-isobutoxybenzamide?
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)-4-isobutoxybenzamide is 526.22 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)-4-isobutoxybenzamide?
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)-4-isobutoxybenzamide 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)-4-isobutoxybenzamide?
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)-4-isobutoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.