7-Ethyl-2-propyl-1-benzothiophene
TL;DR: 7-Ethyl-2-propyl-1-benzothiophene (CAS 16587-46-5) is a chemical compound with molecular formula C13H16S and molecular weight 204.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-ethyl-2-propyl-1-benzothiophene
Also Known As: 7-Ethyl-2-propyl-1-benzothiophene, 7-Ethyl-2-propylbenzo[b]thiophene, Benzo[b]thiophene, 7-ethyl-2-propyl-, 7-Ethyl-2-propyl-1-benzothiophene #, RefChem:310747
| Molecular Formula | C13H16S |
|---|---|
| Molecular Weight | 204.10 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.09727 |
| Heavy Atoms | 14 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 16587-46-5 |
|---|---|
| SMILES | CCCC1=CC2=C(S1)C(=CC=C2)CC |
| InChIKey | RZRNLFMTGXFRLE-UHFFFAOYSA-N |
Product Overview
7-Ethyl-2-propyl-1-benzothiophene (CAS 16587-46-5), with molecular formula C13H16S and molecular weight 204.10 g/mol. IUPAC: 7-ethyl-2-propyl-1-benzothiophene.
Chemical Property Profile of 7-Ethyl-2-propyl-1-benzothiophene
Property Insights of 7-Ethyl-2-propyl-1-benzothiophene
The XLogP value of 4.9 indicates that 7-Ethyl-2-propyl-1-benzothiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, 7-Ethyl-2-propyl-1-benzothiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Ethyl-2-propyl-1-benzothiophene 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 7-Ethyl-2-propyl-1-benzothiophene?
The CAS number of 7-Ethyl-2-propyl-1-benzothiophene is 16587-46-5.
What is the molecular formula of 7-Ethyl-2-propyl-1-benzothiophene?
The molecular formula of 7-Ethyl-2-propyl-1-benzothiophene is C13H16S.
What is the molecular weight of 7-Ethyl-2-propyl-1-benzothiophene?
The molecular weight of 7-Ethyl-2-propyl-1-benzothiophene is 204.10 g/mol.
Where can I buy 7-Ethyl-2-propyl-1-benzothiophene?
You can request a quote for 7-Ethyl-2-propyl-1-benzothiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Ethyl-2-propyl-1-benzothiophene?
Yes, KEHONG BIO provides custom synthesis services for 7-Ethyl-2-propyl-1-benzothiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.