1-Ethyl-5-methyl-4-(piperazinylsulfonyl)pyrazole - CAS 1172262-14-4
Catalog: |
BB042453 |
Product Name: |
1-Ethyl-5-methyl-4-(piperazinylsulfonyl)pyrazole |
CAS: |
1172262-14-4 |
Synonyms: |
1-((1-Ethyl-5-methyl-1H-pyrazol-4-yl)sulfonyl)piperazine; 1-ethyl-5-methyl-4-(piperazinylsulfonyl)pyrazole; 1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)sulfonyl]piperazine; SBB025036 |
IUPAC Name: | 1-(1-ethyl-5-methylpyrazol-4-yl)sulfonylpiperazine |
Description: | 1-Ethyl-5-methyl-4-(piperazinylsulfonyl)pyrazole (CAS# 1172262-14-4 ) is a useful research chemical. |
Molecular Weight: | 258.34 |
Molecular Formula: | C10H18N4O2S |
Canonical SMILES: | CCN1C(=C(C=N1)S(=O)(=O)N2CCNCC2)C |
InChI: | InChI=1S/C10H18N4O2S/c1-3-14-9(2)10(8-12-14)17(15,16)13-6-4-11-5-7-13/h8,11H,3-7H2,1-2H3 |
InChI Key: | POBHVYAIFZUKSC-UHFFFAOYSA-N |
Complexity: | 348 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 258.115047 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 258.115047 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 75.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.6 |
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