![2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one structure](/static/products/1443/1443-75-0.webp)
2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one
TL;DR: 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one (CAS 1443-75-0) 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.
2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one
Also Known As: 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one, 2-benzylidene-2h-thieno[3,2-b]pyrrol-3(4h)-one, (2E)-2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one, 3-benzylidene-4-thia-8-azabicyclo[3.3.0]octa-6,9-dien-2-one
| Molecular Formula | C13H9NOS |
|---|---|
| Molecular Weight | 227.04 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 227.04048 |
| Heavy Atoms | 16 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 1443-75-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=C2C(=O)C3=C(S2)C=CN3 |
| InChIKey | KQCXLNZGVDLLSJ-UHFFFAOYSA-N |
Product Overview
2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one (CAS 1443-75-0), with molecular formula C13H9NOS and molecular weight 227.04 g/mol. IUPAC: 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one.
Chemical Property Profile of 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one
Property Insights of 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one
The XLogP value of 3.3 indicates that 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one 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 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one?
The CAS number of 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one is 1443-75-0.
What is the molecular formula of 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one?
The molecular formula of 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one is C13H9NOS.
What is the molecular weight of 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one?
The molecular weight of 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one is 227.04 g/mol.
Where can I buy 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one?
You can request a quote for 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-benzylidene-4H-thieno[3,2-b]pyrrol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.