2-({4-[(4-Methyl-1-piperidinyl)sulfonyl]phenyl}hydrazono)malononitrile
Basic information
- CAS
328025-24-7- Standard SMILES
CC1CCN(S(=O)(=O)c2ccc(NN=C(C#N)C#N)cc2)CC1- InChIKey
SLUANMNWRBTJSU-UHFFFAOYSA-N- Molecular formula
- C15H17N5O2S
- Average molar mass
- 331.4 g/mol
- Monoisotopic mass
- 331.11029598
Names & identifiers
- Preferred name
- 2-({4-[(4-Methyl-1-piperidinyl)sulfonyl]phenyl}hydrazono)malononitrile
- IUPAC
- 2-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]hydrazinylidene]propanedinitrile
- English name
- ({4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl}hydrazono)malononitrile
- Molecular formula
- C15H17N5O2S
- Molecular weight
- 331.39
Names & synonyms
328025-24-72-({4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl}hydrazono)malononitrile2-[2-[4-[(4-Methyl-1-piperidinyl)sulfonyl]phenyl]hydrazinylidene]propanedinitrileCHEMBL1579585REGID_for_CID_832948DTXSID101133437STK045970AKOS000488785AN-329/40487185[4-(4-Methylpiperidine-1-sulfonyl)phenyl]carbonohydrazonoyl dicyanide(2-{4-[(4-methylpiperidin-1-yl)sulfonyl]phenyl}hydrazinylidene)propanedinitrile({4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl}hydrazono)malononitrile
Show more names
Propanedinitrile, 2-[2-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]hydrazinylidene]-
Database identifiers
- CAS
328025-24-7- PubChem CID
- 832948
- DTXSID
DTXSID101133437- ChEMBL
CHEMBL1579585
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 614
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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