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Ro 18-5364 structure
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Ro 18-5364

TL;DR: Ro 18-5364 (CAS 101388-01-6) is a chemical compound with molecular formula C22H25N3O3S and molecular weight 411.16165 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[(4-methoxy-3-methyl-2-pyridinyl)methylsulfinyl]-5,5,7,7-tetramethyl-3H-cyclopenta[f]benzimidazol-6-one

Also Known As: Ro 18-5364, Ro-18-5364, 5,7-Dihydro-2-(((4-methoxy-3-methyl-2-pyridyl)methyl)sulfinyl)-5,5,7,7-tetramethylindeno(5,6-d)imidazol-6(1H)-one, 2-[(4-methoxy-3-methylpyridin-2-yl)methylsulfinyl]-5,5,7,7-tetramethyl-3H-cyclopenta[f]benzimidazol-6-one, 2-(((4-Methoxy-3-methylpyridin-2-yl)methyl)sulfinyl)-5,5,7,7-tetramethyl-5,7-dihydroindeno[5,6-d]imidazol-6(1H)-one

CAS Number
101388-01-6
Molecular Formula
C22H25N3O3S
Molecular Weight
411.16165 g/mol
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Application Areas

Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (15 patents) Pharmaceutical Intermediates (16 patents) Photographic Chemicals (1 patents)

Technical Specifications

Molecular FormulaC22H25N3O3S
Molecular Weight411.16165 g/mol
XLogP3.1
Topological Polar Surface Area (TPSA)104.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds4
Exact Mass411.16165 Da
Heavy Atoms29
Complexity682.0
SMILESCC1=C(C=CN=C1CS(=O)C2=NC3=C(N2)C=C4C(=C3)C(C(=O)C4(C)C)(C)C)OC
InChIKeyYBCJDBBYBFMVEG-UHFFFAOYSA-N

Product Description

Applications: Ro 18-5364 is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

Ro 18-5364 is a pharmaceutical intermediate identified by CAS number 101388-01-6 and the molecular formula C22H25N3O3S and a molecular weight of 411.16 g/mol. Synonyms include Ro 18-5364 and ACMC-20m4f5.

Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Ro 18-5364

XLogP
3.1
TPSA (Topological Polar Surface Area)
104.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
4
Heavy Atoms
29
Complexity
682.0
Exact Mass
411.16165
Monoisotopic Mass
411.16165
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 18-5364

The XLogP value of 3.1 indicates that Ro 18-5364 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ro 18-5364. Following Lipinski's Rule of Five, Ro 18-5364 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Ro 18-5364?

The CAS number of Ro 18-5364 is 101388-01-6.

What is the molecular formula of Ro 18-5364?

The molecular formula of Ro 18-5364 is C22H25N3O3S.

What is the molecular weight of Ro 18-5364?

The molecular weight of Ro 18-5364 is 411.16165 g/mol.

What are the applications of Ro 18-5364?

Ro 18-5364 is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...

Where can I buy Ro 18-5364?

You can request a quote for Ro 18-5364 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Ro 18-5364?

Yes, CoreyChem provides custom synthesis services for Ro 18-5364 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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