![1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone structure](/static/products/2630/26303-33-3.webp)
1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone
TL;DR: 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone (CAS 26303-33-3) is a chemical compound with molecular formula C13H12N2O3 and molecular weight 244.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone
Also Known As: BAS 02077968, 3-((1E)-2-nitroprop-1-enyl)-1-acetylindole, 1-[3-(2-Nitro-propenyl)-indol-1-yl]-ethanone, 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone, (E)-1-(3-(2-nitroprop-1-en-1-yl)-1H-indol-1-yl)ethanone
| Molecular Formula | C13H12N2O3 |
|---|---|
| Molecular Weight | 244.08 g/mol |
| LogP | 2.9389 |
| Topological Polar Surface Area | 65.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 244.0848 |
| Heavy Atoms | 18 |
| Complexity | 667.9262 |
Chemical Identifiers
| CAS Number | 26303-33-3 |
|---|---|
| SMILES | C/C(=C\C1=CN(C2=CC=CC=C21)C(=O)C)/[N+](=O)[O-] |
Product Overview
1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone (CAS 26303-33-3), with molecular formula C13H12N2O3 and molecular weight 244.08 g/mol. IUPAC: 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone.
Chemical Property Profile of 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone
Property Insights of 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone
The XLogP value of 2.9389 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone. The TPSA of 65.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone. Following Lipinski's Rule of Five, 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone has 0 hydrogen bond donor(s) and 3 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 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone?
The CAS number of 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone is 26303-33-3.
What is the molecular formula of 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone?
The molecular formula of 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone is C13H12N2O3.
What is the molecular weight of 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone?
The molecular weight of 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone is 244.08 g/mol.
Where can I buy 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone?
You can request a quote for 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-[(E)-2-nitroprop-1-enyl]indol-1-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.