[(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate
TL;DR: [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate (CAS 19988-92-2) is a chemical compound with molecular formula C15H16N2O4 and molecular weight 288.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate
Also Known As: 5-(1h-indol-3-yl)-4-nitropent-4-en-1-yl acetate, [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate
| Molecular Formula | C15H16N2O4 |
|---|---|
| Molecular Weight | 288.11 g/mol |
| LogP | 3.1288 |
| Topological Polar Surface Area | 85.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 288.111 |
| Heavy Atoms | 21 |
| Complexity | 687.7934 |
Chemical Identifiers
| CAS Number | 19988-92-2 |
|---|---|
| SMILES | CC(=O)OCCC/C(=C\C1=CNC2=CC=CC=C21)/[N+](=O)[O-] |
Product Overview
[(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate (CAS 19988-92-2), with molecular formula C15H16N2O4 and molecular weight 288.11 g/mol. IUPAC: [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate.
Chemical Property Profile of [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate
Property Insights of [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate
The XLogP value of 3.1288 indicates that [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.23 Ų falls within the moderate polarity range, balancing permeability and solubility for [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate. Following Lipinski's Rule of Five, [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate has 1 hydrogen bond donor(s) and 4 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 [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate?
The CAS number of [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate is 19988-92-2.
What is the molecular formula of [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate?
The molecular formula of [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate is C15H16N2O4.
What is the molecular weight of [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate?
The molecular weight of [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate is 288.11 g/mol.
Where can I buy [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate?
You can request a quote for [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [(E)-5-(1H-indol-3-yl)-4-nitropent-4-enyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.