異苯并噻吩
TL;DR: 異苯并噻吩 (CAS 270-82-6) is a chemical compound with molecular formula C1=CC2=CSC=C2C=C1 and molecular weight 134.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
異苯并噻吩
2-benzothiophene
Also Known As: Benzo[c]thiophene, 2-Benzothiophene, Benzo(c)thiophene, isobenzothiophene, isothianaphthene
| Molecular Formula | C1=CC2=CSC=C2C=C1 |
|---|---|
| Molecular Weight | 134.02 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 134.01903 |
| Heavy Atoms | 9 |
| Complexity | 88.0 |
Chemical Identifiers
| CAS Number | 270-82-6 |
|---|---|
| SMILES | C1=CC2=CSC=C2C=C1 |
| InChIKey | LYTMVABTDYMBQK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
異苯并噻吩 (CAS 270-82-6), with molecular formula C1=CC2=CSC=C2C=C1 and molecular weight 134.02 g/mol. IUPAC: 2-benzothiophene.
Chemical Property Profile of 異苯并噻吩
Property Insights of 異苯并噻吩
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 異苯并噻吩. With a topological polar surface area (TPSA) of 28.2 Ų, 異苯并噻吩 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 異苯并噻吩 has 0 hydrogen bond donor(s) and 1 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 異苯并噻吩?
The CAS number of 異苯并噻吩 is 270-82-6.
What is the molecular formula of 異苯并噻吩?
The molecular formula of 異苯并噻吩 is C1=CC2=CSC=C2C=C1.
What is the molecular weight of 異苯并噻吩?
The molecular weight of 異苯并噻吩 is 134.02 g/mol.
Where can I buy 異苯并噻吩?
You can request a quote for 異苯并噻吩 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 異苯并噻吩?
Yes, KEHONG BIO provides custom synthesis services for 異苯并噻吩 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.