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PD 81723 structure
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PD 81723

TL;DR: PD 81723 (CAS 132861-87-1) is a chemical compound with molecular formula C14H12F3NOS and molecular weight 299.05917 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2-amino-4,5-dimethylthiophen-3-yl)-[3-(trifluoromethyl)phenyl]methanone

Also Known As: PD 81723, (2-amino-4,5-dimethylthiophen-3-yl)(3-(trifluoromethyl)phenyl)methanone, (2-AMINO-4,5-DIMETHYL-3-THIENYL)-[3-(TRIFLUOROMETHYL)PHENYL]METHANONE, PD 81,723, 6013AA

CAS Number
132861-87-1
Molecular Formula
C14H12F3NOS
Molecular Weight
299.05917 g/mol
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Application Areas

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

Agrochemicals (1 patents) Heterocyclic Building Blocks (9 patents) Pharmaceutical Intermediates (6 patents)

Technical Specifications

Molecular FormulaC14H12F3NOS
Molecular Weight299.05917 g/mol
XLogP4.8
Topological Polar Surface Area (TPSA)71.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds2
Exact Mass299.05917 Da
Heavy Atoms20
Complexity374.0
SMILESCC1=C(SC(=C1C(=O)C2=CC(=CC=C2)C(F)(F)F)N)C
InChIKeyKKDKAWKYGCUOGR-UHFFFAOYSA-N

Chemical Property Profile of PD 81723

XLogP
4.8
TPSA (Topological Polar Surface Area)
71.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
2
Heavy Atoms
20
Complexity
374.0
Exact Mass
299.05917
Monoisotopic Mass
299.05917
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 PD 81723

The XLogP value of 4.8 indicates that PD 81723 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.3 Ų falls within the moderate polarity range, balancing permeability and solubility for PD 81723. Following Lipinski's Rule of Five, PD 81723 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 PD 81723?

The CAS number of PD 81723 is 132861-87-1.

What is the molecular formula of PD 81723?

The molecular formula of PD 81723 is C14H12F3NOS.

What is the molecular weight of PD 81723?

The molecular weight of PD 81723 is 299.05917 g/mol.

Where can I buy PD 81723?

You can request a quote for PD 81723 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for PD 81723?

Yes, CoreyChem provides custom synthesis services for PD 81723 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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