Basic information
- CAS
40890-96-8- Standard SMILES
CN1CCN(CN(O)C(=O)c2ccc(F)cc2)CC1- InChIKey
CWQLKDMTAQKSEX-UHFFFAOYSA-N- Molecular formula
- C13H18FN3O2
- Average molar mass
- 267.3 g/mol
- Monoisotopic mass
- 267.13830499
Names & identifiers
- Preferred name
- Benzohydroxamic acid, 4-fluoro-N-(4-methylpiperazinyl)methyl-
- IUPAC
- 4-fluoro-N-hydroxy-N-[(4-methylpiperazin-1-yl)methyl]benzamide
- English name
- 4-Fluoro-N-[(4-methyl-1-piperazinyl)methyl]benzohydroxamic acid
- Molecular weight
- 0
Names & synonyms
40890-96-8BRN 0539322BENZOHYDROXAMIC ACID, 4-FLUORO-N-(4-METHYLPIPERAZINYL)METHYL-4-Fluoro-N-(4-methylpiperazinyl)methylbenzohydroxamic acidDTXSID501938955-23-01-00086 (Beilstein Handbook Reference)RefChem:326495DTXCID901163864-fluoro-N-hydroxy-N-[(4-methylpiperazin-1-yl)methyl]benzamide4-Fluoro-N-hydroxy-N-[(4-methyl-1-piperazinyl)methyl]benzamide4-Fluoro-N-[(4-methyl-1-piperazinyl)methyl]benzohydroxamic acid
Database identifiers
- CAS
40890-96-8- PubChem CID
- 38703
- DTXSID
DTXSID50193895- Nikkaji
- J41.236H
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 47 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 300
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…