1,3-二乙酰基-1H-吲哚
TL;DR: 1,3-二乙酰基-1H-吲哚 (CAS 17537-64-3) is a chemical compound with molecular formula C12H11NO2 and molecular weight 201.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-二乙酰基-1H-吲哚
1-(1-acetylindol-3-yl)ethanone
Also Known As: 1,3-Diacetylindole, 1,3-Diacetyl-1H-indole, Desaspidin, 1-(1-acetylindol-3-yl)ethanone, 1,1'-(1H-Indole-1,3-diyl)diethanone
| Molecular Formula | C12H11NO2 |
|---|---|
| Molecular Weight | 201.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 39.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.07898 |
| Heavy Atoms | 15 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 17537-64-3 |
|---|---|
| SMILES | CC(=O)C1=CN(C2=CC=CC=C21)C(=O)C |
| InChIKey | STUZJORZRZCLRI-UHFFFAOYSA-N |
Product Overview
1,3-二乙酰基-1H-吲哚 (CAS 17537-64-3), with molecular formula C12H11NO2 and molecular weight 201.08 g/mol. IUPAC: 1-(1-acetylindol-3-yl)ethanone.
Chemical Property Profile of 1,3-二乙酰基-1H-吲哚
Property Insights of 1,3-二乙酰基-1H-吲哚
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-二乙酰基-1H-吲哚. With a topological polar surface area (TPSA) of 39.1 Ų, 1,3-二乙酰基-1H-吲哚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-二乙酰基-1H-吲哚 has 0 hydrogen bond donor(s) and 2 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 1,3-二乙酰基-1H-吲哚?
The CAS number of 1,3-二乙酰基-1H-吲哚 is 17537-64-3.
What is the molecular formula of 1,3-二乙酰基-1H-吲哚?
The molecular formula of 1,3-二乙酰基-1H-吲哚 is C12H11NO2.
What is the molecular weight of 1,3-二乙酰基-1H-吲哚?
The molecular weight of 1,3-二乙酰基-1H-吲哚 is 201.08 g/mol.
Where can I buy 1,3-二乙酰基-1H-吲哚?
You can request a quote for 1,3-二乙酰基-1H-吲哚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-二乙酰基-1H-吲哚?
Yes, KEHONG BIO provides custom synthesis services for 1,3-二乙酰基-1H-吲哚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.