Basic information
- CAS
939758-14-2- Standard SMILES
Cc1[nH]c(=O)sc1S(=O)(=O)N1CCNCC1- InChIKey
GTIPEMJXYYUUTM-UHFFFAOYSA-N- Molecular formula
- C8H13N3O3S2
- Average molar mass
- 263.3 g/mol
- Monoisotopic mass
- 263.03983363
Names & identifiers
- Preferred name
- 4-Methyl-5-(piperazin-1-ylsulfonyl)thiazol-2(3H)-one
- IUPAC
- 4-methyl-5-piperazin-1-ylsulfonyl-3H-1,3-thiazol-2-one
Names & synonyms
939758-14-24-Methyl-5-(piperazin-1-ylsulfonyl)thiazol-2(3H)-one4-methyl-5-(piperazine-1-sulfonyl)-2,3-dihydro-1,3-thiazol-2-oneDTXSID101224252AKOS009117932EN300-348264-Methyl-5-(1-piperazinylsulfonyl)-2(3H)-thiazolone4-Methyl-5-(piperazine-1-sulfonyl)-1,3-thiazol-2(3H)-one
Database identifiers
- CAS
939758-14-2- PubChem CID
- 16227828
- DTXSID
DTXSID101224252
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 432
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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