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Gyki 52895 structure
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Gyki 52895

TL;DR: Gyki 52895 (CAS 114460-08-1) is a chemical compound with molecular formula C17H17N3O2 and molecular weight 295.13208 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-(4-Aminophenyl)-4-methyl-7,8-

4-(8-methyl-8,9-dihydro-7H-[1,3]dioxolo[4,5-h][2,3]benzodiazepin-5-yl)aniline

Also Known As: GYKI 52895, Lopac0_000562, 2387AA, 1-(4-Aminophenyl)-4-methyl-7,8-, 4-(8-Methyl-8,9-dihydro-7H-[1,3]dioxolo[4',5':4,5]benzo[1,2-d][1,2]diazepin-5-yl)aniline

CAS Number
114460-08-1
Molecular Formula
C17H17N3O2
Molecular Weight
295.13208 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 (26 patents) Pharmaceutical Intermediates (17 patents)

Technical Specifications

Molecular FormulaC17H17N3O2
Molecular Weight295.13208 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)68.9 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors5
Rotatable Bonds1
Exact Mass295.13208 Da
Heavy Atoms22
Complexity434.0
SMILESCC1CC2=CC3=C(C=C2C(=NN1)C4=CC=C(C=C4)N)OCO3
InChIKeyAQTITSBNGSVQNZ-UHFFFAOYSA-N

Product Description

Applications: Gyki 52895 is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. 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).

A heterocyclic building block supplied by CoreyChem, Gyki 52895 (CAS 114460-08-1) has the molecular formula C17H17N3O2 and a molecular weight of 295.13 g/mol. Synonyms include GYKI 52895 and Lopac0_000562.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Gyki 52895

XLogP
3.3
TPSA (Topological Polar Surface Area)
68.9
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
1
Heavy Atoms
22
Complexity
434.0
Exact Mass
295.13208
Monoisotopic Mass
295.13208
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 Gyki 52895

The XLogP value of 3.3 indicates that Gyki 52895 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Gyki 52895. Following Lipinski's Rule of Five, Gyki 52895 has 2 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 Gyki 52895?

The CAS number of Gyki 52895 is 114460-08-1.

What is the molecular formula of Gyki 52895?

The molecular formula of Gyki 52895 is C17H17N3O2.

What is the molecular weight of Gyki 52895?

The molecular weight of Gyki 52895 is 295.13208 g/mol.

What are the applications of Gyki 52895?

Gyki 52895 is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...

Where can I buy Gyki 52895?

You can request a quote for Gyki 52895 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Gyki 52895?

Yes, CoreyChem provides custom synthesis services for Gyki 52895 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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