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RefChem:219020 structure
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RefChem:219020

TL;DR: RefChem:219020 (CAS 20884-95-1) is a chemical compound with molecular formula C19H21NO4S and molecular weight 359.11914 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-(4-propan-2-ylsulfonylphenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline

Also Known As: 5,6,7,8-Tetrahydro-5-(p-(isopropylsulfonyl)phenyl)-1,3-dioxolo(4,5-g)isoquinoline, 1,2,3,4-Tetrahydro-1-(p-(isopropylsulfonyl)phenyl)-6,7-methylenedioxyisoquinoline, 1,3-Dioxolo(4,5-g)isoquinoline, 5,6,7,8-tetrahydro-5-(p-(isopropylsulfonyl)phenyl)-, 5,6,7,8-Tetrahydro-5-[4- phenyl]-1,3-dioxolo[4,5-g]isoquinoline, 5-(4-propan-2-ylsulfonylphenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline

CAS Number
20884-95-1
Molecular Formula
C19H21NO4S
Molecular Weight
359.11914 g/mol
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Technical Specifications

Molecular FormulaC19H21NO4S
Molecular Weight359.11914 g/mol
XLogP2.9
Topological Polar Surface Area (TPSA)73.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds3
Exact Mass359.11914 Da
Heavy Atoms25
Complexity564.0
SMILESCC(C)S(=O)(=O)C1=CC=C(C=C1)C2C3=CC4=C(C=C3CCN2)OCO4
InChIKeySRKFWJCAFAQJMD-UHFFFAOYSA-N

Chemical Property Profile of RefChem:219020

XLogP
2.9
TPSA (Topological Polar Surface Area)
73.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
3
Heavy Atoms
25
Complexity
564.0
Exact Mass
359.11914
Monoisotopic Mass
359.11914
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of RefChem:219020

The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:219020. The TPSA of 73.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:219020. Following Lipinski's Rule of Five, RefChem:219020 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of RefChem:219020?

The CAS number of RefChem:219020 is 20884-95-1.

What is the molecular formula of RefChem:219020?

The molecular formula of RefChem:219020 is C19H21NO4S.

What is the molecular weight of RefChem:219020?

The molecular weight of RefChem:219020 is 359.11914 g/mol.

Where can I buy RefChem:219020?

You can request a quote for RefChem:219020 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:219020?

Yes, CoreyChem provides custom synthesis services for RefChem:219020 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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