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2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline
TL;DR: 2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline (CAS 385407-79-4) is a chemical compound with molecular formula C13H12ClNO2S2 and molecular weight 313.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-chlorothiophen-2-yl)sulfonyl-3,4-dihydro-1H-isoquinoline
Also Known As: AF-399/15599123, 2-[(5-chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline, 2-(5-chlorothiophen-2-yl)sulfonyl-3,4-dihydro-1H-isoquinoline, 2-[(5-CHLORO-2-THIENYL)SULFONYL]-1,2,3,4-TETRAHYDROISOQUINOLINE, 5-chloro-2-(2-1,2,3,4-tetrahydroisoquinolylsulfonyl)thiophene
| Molecular Formula | C13H12ClNO2S2 |
|---|---|
| Molecular Weight | 313.00 g/mol |
| LogP | 3.1485 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.9998 |
| Heavy Atoms | 19 |
| Complexity | 708.93823 |
Chemical Identifiers
| CAS Number | 385407-79-4 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(S3)Cl |
Product Overview
2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline (CAS 385407-79-4), with molecular formula C13H12ClNO2S2 and molecular weight 313.00 g/mol. IUPAC: 2-(5-chlorothiophen-2-yl)sulfonyl-3,4-dihydro-1H-isoquinoline.
Chemical Property Profile of 2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline
Property Insights of 2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline
The XLogP value of 3.1485 indicates that 2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, 2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline has 0 hydrogen bond donor(s) and 3 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-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline?
The CAS number of 2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline is 385407-79-4.
What is the molecular formula of 2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline?
The molecular formula of 2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline is C13H12ClNO2S2.
What is the molecular weight of 2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline?
The molecular weight of 2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline is 313.00 g/mol.
Where can I buy 2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline?
You can request a quote for 2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 2-[(5-Chlorothiophen-2-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.