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Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide structure
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Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide

TL;DR: Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide (CAS 1300732-78-8) is a chemical compound with molecular formula C10H9ClN3NaS and molecular weight 261.01035 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

sodium 5-(4-chlorophenyl)-4-ethyl-1,2,4-triazole-3-thiolate

Also Known As: sodium 5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazole-3-thiolate, sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide, sodium [5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanide, sodium;5-(4-chlorophenyl)-4-ethyl-1,2,4-triazole-3-thiolate, F8889-9338

CAS Number
1300732-78-8
Molecular Formula
C10H9ClN3NaS
Molecular Weight
261.01035 g/mol
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Technical Specifications

Molecular FormulaC10H9ClN3NaS
Molecular Weight261.01035 g/mol
XLogP-0.4718
Topological Polar Surface Area (TPSA)31.7 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors3
Rotatable Bonds2
Exact Mass261.01035 Da
Heavy Atoms16
Complexity214.0
SMILESCCN1C(=NN=C1[S-])C2=CC=C(C=C2)Cl.[Na+]
InChIKeyDBBYFZQIOVVWAL-UHFFFAOYSA-M

Chemical Property Profile of Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide

XLogP
-0.4718
TPSA (Topological Polar Surface Area)
31.7
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
16
Complexity
214.0
Exact Mass
261.01035
Monoisotopic Mass
261.01035
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 Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide

The XLogP value of -0.4718 indicates that Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 31.7 Ų, Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide 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 Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide?

The CAS number of Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide is 1300732-78-8.

What is the molecular formula of Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide?

The molecular formula of Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide is C10H9ClN3NaS.

What is the molecular weight of Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide?

The molecular weight of Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide is 261.01035 g/mol.

Where can I buy Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide?

You can request a quote for Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide?

Yes, CoreyChem provides custom synthesis services for Sodium [5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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