ChemDiv1_022256
TL;DR: ChemDiv1_022256 (CAS 373377-17-4) is a chemical compound with molecular formula C24H19BrN2O5 and molecular weight 494.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-1-(1,3-benzodioxol-5-yl)-3-(4-methoxyanilino)-3-oxoprop-1-en-2-yl]-4-bromobenzamide
Also Known As: ChemDiv1_022256, N-(2-(1,3-benzodioxol-5-yl)-1-{[(4-methoxyphenyl)amino]carbonyl}vinyl)-4-bromobenzamide, (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((4-methoxyphenyl)amino)-3-oxoprop-1-en-2-yl)-4-bromobenzamide, N-[(E)-1-(1,3-benzodioxol-5-yl)-3-(4-methoxyanilino)-3-oxoprop-1-en-2-yl]-4-bromobenzamide
| Molecular Formula | C24H19BrN2O5 |
|---|---|
| Molecular Weight | 494.05 g/mol |
| LogP | 4.596 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 494.04773 |
| Heavy Atoms | 32 |
| Complexity | 1173.9989 |
Chemical Identifiers
| CAS Number | 373377-17-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)/C(=C\C2=CC3=C(C=C2)OCO3)/NC(=O)C4=CC=C(C=C4)Br |
Product Overview
ChemDiv1_022256 (CAS 373377-17-4), with molecular formula C24H19BrN2O5 and molecular weight 494.05 g/mol. IUPAC: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-(4-methoxyanilino)-3-oxoprop-1-en-2-yl]-4-bromobenzamide.
Chemical Property Profile of ChemDiv1_022256
Property Insights of ChemDiv1_022256
The XLogP value of 4.596 indicates that ChemDiv1_022256 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.89 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_022256. Following Lipinski's Rule of Five, ChemDiv1_022256 has 2 hydrogen bond donor(s) and 5 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 ChemDiv1_022256?
The CAS number of ChemDiv1_022256 is 373377-17-4.
What is the molecular formula of ChemDiv1_022256?
The molecular formula of ChemDiv1_022256 is C24H19BrN2O5.
What is the molecular weight of ChemDiv1_022256?
The molecular weight of ChemDiv1_022256 is 494.05 g/mol.
Where can I buy ChemDiv1_022256?
You can request a quote for ChemDiv1_022256 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022256?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022256 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.