N'-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N'-methyl-2-thiophenesulfonohydrazide
Basic information
- CAS
400082-51-1- Standard SMILES
CN(NS(=O)(=O)c1cccs1)c1ncc(C(F)(F)F)cc1Cl- InChIKey
VEZGBFYNIUNJLK-UHFFFAOYSA-N- Molecular formula
- C11H9ClF3N3O2S2
- Average molar mass
- 371.8 g/mol
- Monoisotopic mass
- 370.9776811
Names & identifiers
- Preferred name
- N'-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N'-methyl-2-thiophenesulfonohydrazide
- IUPAC
- N'-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N'-methylthiophene-2-sulfonohydrazide
Names & synonyms
400082-51-1N'-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N'-methyl-2-thiophenesulfonohydrazideN'-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N'-methylthiophene-2-sulfonohydrazideN'-(3-chloro-5-(trifluoromethyl)pyridin-2-yl)-N'-methylthiophene-2-sulfonohydrazideMLS001099653CHEMBL1418435DTXSID501333037HMS2995J13MFCD01871491AKOS005090581SMR0006725384M-915
Show more names
N'-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N'-methyl-thiophene-2-sulfonohydrazide
Database identifiers
- CAS
400082-51-1- PubChem CID
- 1476867
- DTXSID
DTXSID501333037- ChEMBL
CHEMBL1418435
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 98.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 486
Experimental & physicochemical properties
Solubility27.7 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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