3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one
TL;DR: 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one (CAS 6971-81-9) is a chemical compound with molecular formula C17H13NO2 and molecular weight 263.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one
Also Known As: 3- -3H-isobenzofuran-1-one, 3-(1-Methyl-1H-indol-3-yl)isobenzofuran-1(3H)-one, 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one, 3-(1-methyl-1h-indol-3-yl)-2-benzofuran-1(3h)-one, 3-(1-METHYLINDOL-3-YL)-3H-ISOBENZOFURAN-1-ONE
| Molecular Formula | C17H13NO2 |
|---|---|
| Molecular Weight | 263.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 31.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 263.09464 |
| Heavy Atoms | 20 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 6971-81-9 |
|---|---|
| SMILES | CN1C=C(C2=CC=CC=C21)C3C4=CC=CC=C4C(=O)O3 |
| InChIKey | JTAPDIWCIJLNAH-UHFFFAOYSA-N |
Product Overview
3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one (CAS 6971-81-9), with molecular formula C17H13NO2 and molecular weight 263.09 g/mol. IUPAC: 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one.
Chemical Property Profile of 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one
Property Insights of 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one
The XLogP value of 3.1 indicates that 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.2 Ų, 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one 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 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one?
The CAS number of 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one is 6971-81-9.
What is the molecular formula of 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one?
The molecular formula of 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one is C17H13NO2.
What is the molecular weight of 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one?
The molecular weight of 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one is 263.09 g/mol.
Where can I buy 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one?
You can request a quote for 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-methylindol-3-yl)-3H-2-benzofuran-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.