![3-[(Thien-2-yl)methylene]-2-indolinone structure](/static/products/853/853356-19-1.png)
3-[(Thien-2-yl)methylene]-2-indolinone
TL;DR: 3-[(Thien-2-yl)methylene]-2-indolinone (CAS 853356-19-1) is a chemical compound with molecular formula C13H9NOS and molecular weight 227.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(thiophen-2-ylmethylidene)-1H-indol-2-one
Also Known As: thienylmethylene oxindole, 3-(Thiophen-2-ylmethylene)indolin-2-one, 3-[(Thien-2-yl)methylene]-2-indolinone, Maybridge3_000930, Benzeneethanamine,N-cyclopropyl
| Molecular Formula | C13H9NOS |
|---|---|
| Molecular Weight | 227.04 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 57.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 227.04048 |
| Heavy Atoms | 16 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 853356-19-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC3=CC=CS3)C(=O)N2 |
| InChIKey | QMTIIBUDOBNABZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-[(Thien-2-yl)methylene]-2-indolinone (CAS 853356-19-1), with molecular formula C13H9NOS and molecular weight 227.04 g/mol. IUPAC: 3-(thiophen-2-ylmethylidene)-1H-indol-2-one.
Chemical Property Profile of 3-[(Thien-2-yl)methylene]-2-indolinone
Property Insights of 3-[(Thien-2-yl)methylene]-2-indolinone
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(Thien-2-yl)methylene]-2-indolinone. With a topological polar surface area (TPSA) of 57.3 Ų, 3-[(Thien-2-yl)methylene]-2-indolinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(Thien-2-yl)methylene]-2-indolinone has 1 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-[(Thien-2-yl)methylene]-2-indolinone?
The CAS number of 3-[(Thien-2-yl)methylene]-2-indolinone is 853356-19-1.
What is the molecular formula of 3-[(Thien-2-yl)methylene]-2-indolinone?
The molecular formula of 3-[(Thien-2-yl)methylene]-2-indolinone is C13H9NOS.
What is the molecular weight of 3-[(Thien-2-yl)methylene]-2-indolinone?
The molecular weight of 3-[(Thien-2-yl)methylene]-2-indolinone is 227.04 g/mol.
Where can I buy 3-[(Thien-2-yl)methylene]-2-indolinone?
You can request a quote for 3-[(Thien-2-yl)methylene]-2-indolinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(Thien-2-yl)methylene]-2-indolinone?
Yes, KEHONG BIO provides custom synthesis services for 3-[(Thien-2-yl)methylene]-2-indolinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.