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6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile structure
Fine Chemical

6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile

TL;DR: 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile (CAS 138292-24-7) is a chemical compound with molecular formula C17H15ClN2S and molecular weight 314.06445 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

6-chloro-3,3-dimethyl-8-phenyl-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile

Also Known As: 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile, 1H-Thiopyrano[3,4-c]pyridine-5-carbonitrile, 6-chloro-3,3-dimethyl-8-phenyl-, 6-chloro-3,3-dimethyl-8-phenyl-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile, 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile #

CAS Number
138292-24-7
Molecular Formula
C17H15ClN2S
Molecular Weight
314.06445 g/mol
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Technical Specifications

Molecular FormulaC17H15ClN2S
Molecular Weight314.06445 g/mol
XLogP4.3
Topological Polar Surface Area (TPSA)62.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors3
Rotatable Bonds1
Exact Mass314.06445 Da
Heavy Atoms21
Complexity424.0
SMILESCC1(CC2=C(CS1)C(=NC(=C2C#N)Cl)C3=CC=CC=C3)C
InChIKeyBCKXMUWUKOIWIY-UHFFFAOYSA-N

Chemical Property Profile of 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile

XLogP
4.3
TPSA (Topological Polar Surface Area)
62.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
1
Heavy Atoms
21
Complexity
424.0
Exact Mass
314.06445
Monoisotopic Mass
314.06445
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 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile

The XLogP value of 4.3 indicates that 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile. Following Lipinski's Rule of Five, 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile 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

What is the CAS number of 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?

The CAS number of 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile is 138292-24-7.

What is the molecular formula of 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?

The molecular formula of 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile is C17H15ClN2S.

What is the molecular weight of 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?

The molecular weight of 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile is 314.06445 g/mol.

Where can I buy 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?

You can request a quote for 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?

Yes, CoreyChem provides custom synthesis services for 6-Chloro-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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