2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione
TL;DR: 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione (CAS 904085-81-0) is a chemical compound with molecular formula C16H10O3S and molecular weight 282.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione
Also Known As: 2-[(2E)-3-(thiophen-2-yl)prop-2-enoyl]-2,3-dihydro-1H-indene-1,3-dione, 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione, 2-(3-thiophen-2-ylprop-2-enoyl)indene-1,3-dione, 2-[(E)-3-(2-thienyl)prop-2-enoyl]indane-1,3-dione, 2-(E)-3-(2-Thienyl)-2-propenoyl-1H-indene-1,3(2H)-dione
| Molecular Formula | C16H10O3S |
|---|---|
| Molecular Weight | 282.04 g/mol |
| LogP | 3.0258 |
| Topological Polar Surface Area | 51.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.03506 |
| Heavy Atoms | 20 |
| Complexity | 690.94006 |
Chemical Identifiers
| CAS Number | 904085-81-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(C2=O)C(=O)/C=C/C3=CC=CS3 |
Product Overview
2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione (CAS 904085-81-0), with molecular formula C16H10O3S and molecular weight 282.04 g/mol. IUPAC: 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione.
Chemical Property Profile of 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione
Property Insights of 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione
The XLogP value of 3.0258 indicates that 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.21 Ų, 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione has 0 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 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione?
The CAS number of 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione is 904085-81-0.
What is the molecular formula of 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione?
The molecular formula of 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione is C16H10O3S.
What is the molecular weight of 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione?
The molecular weight of 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione is 282.04 g/mol.
Where can I buy 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione?
You can request a quote for 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[(E)-3-thiophen-2-ylprop-2-enoyl]indene-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.