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Ro 11-2933 structure
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Ro 11-2933

TL;DR: Ro 11-2933 (CAS 98600-65-8) is a chemical compound with molecular formula C28H35NO2S2 and molecular weight 481.2109 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-(2-naphthalen-2-yl-1,3-dithian-2-yl)propan-1-amine

Also Known As: 3,4-Dmdp, Ro 11-2933, KST-1A9421, Ro-11-2933, 1,3-Dithiane-2-propanamine, N-(2-(3,4-dimethoxyphenyl)ethyl)-N-methyl-2-(2-naphthalenyl)-

CAS Number
98600-65-8
Molecular Formula
C28H35NO2S2
Molecular Weight
481.2109 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (5 patents) Pharmaceutical Intermediates (2 patents)

Technical Specifications

Molecular FormulaC28H35NO2S2
Molecular Weight481.2109 g/mol
XLogP7.0
Topological Polar Surface Area (TPSA)72.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors5
Rotatable Bonds10
Exact Mass481.2109 Da
Heavy Atoms33
Complexity570.0
SMILESCN(CCCC1(SCCCS1)C2=CC3=CC=CC=C3C=C2)CCC4=CC(=C(C=C4)OC)OC
InChIKeyYEXYNWAZYPPKQD-UHFFFAOYSA-N

Chemical Property Profile of Ro 11-2933

XLogP
7.0
TPSA (Topological Polar Surface Area)
72.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
10
Heavy Atoms
33
Complexity
570.0
Exact Mass
481.2109
Monoisotopic Mass
481.2109
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 Ro 11-2933

The XLogP value of 7.0 indicates that Ro 11-2933 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Ro 11-2933. Following Lipinski's Rule of Five, Ro 11-2933 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Ro 11-2933?

The CAS number of Ro 11-2933 is 98600-65-8.

What is the molecular formula of Ro 11-2933?

The molecular formula of Ro 11-2933 is C28H35NO2S2.

What is the molecular weight of Ro 11-2933?

The molecular weight of Ro 11-2933 is 481.2109 g/mol.

Where can I buy Ro 11-2933?

You can request a quote for Ro 11-2933 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Ro 11-2933?

Yes, CoreyChem provides custom synthesis services for Ro 11-2933 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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