2-({5-[2-(4-Chlorophenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide - CAS 832740-38-2
Catalog: |
BB045944 |
Product Name: |
2-({5-[2-(4-Chlorophenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide |
CAS: |
832740-38-2 |
Synonyms: |
Acetic acid, 2-[[5-[2-(4-chlorophenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl]thio]-, hydrazide |
IUPAC Name: | 2-[[5-[2-(4-chlorophenyl)cyclopropyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetohydrazide |
Description: | 2-({5-[2-(4-Chlorophenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide (CAS# 832740-38-2 ) is a useful research chemical. |
Molecular Weight: | 351.9 |
Molecular Formula: | C15H18ClN5OS |
Canonical SMILES: | CCN1C(=NN=C1SCC(=O)NN)C2CC2C3=CC=C(C=C3)Cl |
InChI: | InChI=1S/C15H18ClN5OS/c1-2-21-14(19-20-15(21)23-8-13(22)18-17)12-7-11(12)9-3-5-10(16)6-4-9/h3-6,11-12H,2,7-8,17H2,1H3,(H,18,22) |
InChI Key: | AAVCCTUSLWZLMF-UHFFFAOYSA-N |
Density: | 1.5±0.1 g/cm3 |
Complexity: | 421 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 351.0920591 |
Formal Charge: | 0 |
Heavy Atom Count: | 23 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 351.0920591 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 111 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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