1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone
TL;DR: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone (CAS 349432-59-3) is a chemical compound with molecular formula C15H15NOS and molecular weight 257.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone
Also Known As: TimTec1_003352, BAS 03030327, 2-(2-thienylacetyl)-1,2,3,4-tetrahydroisoquinoline, 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone, AJ-292/40797146
| Molecular Formula | C15H15NOS |
|---|---|
| Molecular Weight | 257.09 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 48.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.08743 |
| Heavy Atoms | 18 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 349432-59-3 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)C(=O)CC3=CC=CS3 |
| InChIKey | RFRICPUOGORAOQ-UHFFFAOYSA-N |
Product Overview
1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone (CAS 349432-59-3), with molecular formula C15H15NOS and molecular weight 257.09 g/mol. IUPAC: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone.
Chemical Property Profile of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone
Property Insights of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone. With a topological polar surface area (TPSA) of 48.6 Ų, 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone has 0 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 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone?
The CAS number of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone is 349432-59-3.
What is the molecular formula of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone?
The molecular formula of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone is C15H15NOS.
What is the molecular weight of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone?
The molecular weight of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone is 257.09 g/mol.
Where can I buy 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone?
You can request a quote for 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.