(1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol
TL;DR: (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol (CAS 496798-13-1) is a chemical compound with molecular formula C17H15BrN2O5 and molecular weight 406.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(2-bromo-4-nitroanilino)-1-(2,4-dimethoxyphenyl)prop-2-en-1-one
Also Known As: (E)-3-(2-bromo-4-nitroanilino)-1-(2,4-dimethoxyphenyl)prop-2-en-1-one, (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol, (E)-3-((2-bromo-4-nitrophenyl)amino)-1-(2,4-dimethoxyphenyl)prop-2-en-1-one
| Molecular Formula | C17H15BrN2O5 |
|---|---|
| Molecular Weight | 406.02 g/mol |
| LogP | 4.183 |
| Topological Polar Surface Area | 90.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 406.01642 |
| Heavy Atoms | 25 |
| Complexity | 835.7831 |
Chemical Identifiers
| CAS Number | 496798-13-1 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C(=O)/C=C/NC2=C(C=C(C=C2)[N+](=O)[O-])Br)OC |
Product Overview
(1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol (CAS 496798-13-1), with molecular formula C17H15BrN2O5 and molecular weight 406.02 g/mol. IUPAC: (E)-3-(2-bromo-4-nitroanilino)-1-(2,4-dimethoxyphenyl)prop-2-en-1-one.
Chemical Property Profile of (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol
Property Insights of (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol
The XLogP value of 4.183 indicates that (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol. Following Lipinski's Rule of Five, (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol 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 (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol?
The CAS number of (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol is 496798-13-1.
What is the molecular formula of (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol?
The molecular formula of (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol is C17H15BrN2O5.
What is the molecular weight of (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol?
The molecular weight of (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol is 406.02 g/mol.
Where can I buy (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol?
You can request a quote for (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol?
Yes, KEHONG BIO provides custom synthesis services for (1Z,3E)-3-[(2-bromo-4-nitrophenyl)imino]-1-(2,4-dimethoxyphenyl)prop-1-en-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.