Basic information
- CAS
57725-12-9- Standard SMILES
CN1CCN(c2ccncc2S(=O)(=O)N2CCCC2)CC1- InChIKey
UIISCJXOTJXHGB-UHFFFAOYSA-N- Molecular formula
- C14H22N4O2S
- Average molar mass
- 310.42 g/mol
- Monoisotopic mass
- 310.14634713
Names & identifiers
- Preferred name
- Mls003115488
- IUPAC
- 1-methyl-4-(3-pyrrolidin-1-ylsulfonyl-4-pyridinyl)piperazine
Names & synonyms
57725-12-9MLS003115488DTXSID10313956RefChem:357305DTXCID90265080NSC2791821-methyl-4-[3-(1-pyrrolidinylsulfonyl)-4-pyridinyl]piperazine1-Methyl-4-(3-(1-pyrrolidinylsulfonyl)-4-pyridinyl)piperazineOprea1_076122CHEMBL1879632NSC-279182SMR001831064
Show more names
AJ-333/361180181-methyl-4-(3-pyrrolidin-1-ylsulfonyl-4-pyridyl)piperazine1-Methyl-4-[3-(pyrrolidine-1-sulfonyl)pyridin-4-yl]piperazine
Database identifiers
- CAS
57725-12-9- PubChem CID
- 322290
- DTXSID
DTXSID10313956- ChEMBL
CHEMBL1879632
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 65.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 436
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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