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1-[3-(3-Nitroanilino)indol-1-yl]ethanone
TL;DR: 1-[3-(3-Nitroanilino)indol-1-yl]ethanone (CAS 352548-56-2) is a chemical compound with molecular formula C16H13N3O3 and molecular weight 295.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(3-nitroanilino)indol-1-yl]ethanone
Also Known As: 1-[3-(3-nitroanilino)indol-1-yl]ethanone, 1-acetyl-3-(3'-nitrophenyl)aminoindole, 1-acetyl-3-{3-nitroanilino}-1H-indole, BIM-0041995.P001, AH-262/11508029
| Molecular Formula | C16H13N3O3 |
|---|---|
| Molecular Weight | 295.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 79.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 295.0957 |
| Heavy Atoms | 22 |
| Complexity | 437.0 |
Chemical Identifiers
| CAS Number | 352548-56-2 |
|---|---|
| SMILES | CC(=O)N1C=C(C2=CC=CC=C21)NC3=CC(=CC=C3)[N+](=O)[O-] |
| InChIKey | FMVJSAMWISBCRY-UHFFFAOYSA-N |
Product Overview
1-[3-(3-Nitroanilino)indol-1-yl]ethanone (CAS 352548-56-2), with molecular formula C16H13N3O3 and molecular weight 295.10 g/mol. IUPAC: 1-[3-(3-nitroanilino)indol-1-yl]ethanone.
Chemical Property Profile of 1-[3-(3-Nitroanilino)indol-1-yl]ethanone
Property Insights of 1-[3-(3-Nitroanilino)indol-1-yl]ethanone
The XLogP value of 3.3 indicates that 1-[3-(3-Nitroanilino)indol-1-yl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[3-(3-Nitroanilino)indol-1-yl]ethanone. Following Lipinski's Rule of Five, 1-[3-(3-Nitroanilino)indol-1-yl]ethanone 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 1-[3-(3-Nitroanilino)indol-1-yl]ethanone?
The CAS number of 1-[3-(3-Nitroanilino)indol-1-yl]ethanone is 352548-56-2.
What is the molecular formula of 1-[3-(3-Nitroanilino)indol-1-yl]ethanone?
The molecular formula of 1-[3-(3-Nitroanilino)indol-1-yl]ethanone is C16H13N3O3.
What is the molecular weight of 1-[3-(3-Nitroanilino)indol-1-yl]ethanone?
The molecular weight of 1-[3-(3-Nitroanilino)indol-1-yl]ethanone is 295.10 g/mol.
Where can I buy 1-[3-(3-Nitroanilino)indol-1-yl]ethanone?
You can request a quote for 1-[3-(3-Nitroanilino)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-(3-Nitroanilino)indol-1-yl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-(3-Nitroanilino)indol-1-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.