Basic information
- Standard SMILES
CN(O)C(=O)c1cc2c(CN3CCNC(=O)C3)cn(Cc3ccc(F)cc3)c2cn1- InChIKey
YTWDEGGJCJTNOH-UHFFFAOYSA-N- Molecular formula
- C21H22FN5O3
- Average molar mass
- 411.4 g/mol
Names & identifiers
- Preferred name
- 1h-Pyrrolo[2,3-c]pyridine-5-carboxamide,1-[(4-fluorophenyl)methyl]-n-hydroxy-n-methyl-3-[(3-oxo-1-piperazinyl)methyl]-
- IUPAC
- 1-[(4-fluorophenyl)methyl]-N-hydroxy-N-methyl-3-[(3-oxopiperazin-1-yl)methyl]pyrrolo[2,3-c]pyridine-5-carboxamide
Names & synonyms
1h-pyrrolo[2,3-c]pyridine-5-carboxamide,1-[(4-fluorophenyl)methyl]-n-hydroxy-n-methyl-3-[(3-oxo-1-piperazinyl)methyl]-868551-15-9SCHEMBL4800116CHEMBL1289200YTWDEGGJCJTNOH-UHFFFAOYSA-N1-(4-fluorobenzyl)-N-hydroxy-N-methyl-3-((3-oxopiperazin-1-yl)methyl)-1H-pyrrolo[2,3-c]pyridine-5-carboxamide1-[(4-fluorophenyl)methyl]-N-hydroxy-N-methyl-3-[(3-oxopiperazin-1-yl)methyl]pyrrolo[2,3-c]pyridine-5-carboxamide1H-Pyrrolo[2,3-c]pyridine-5-carboxamide, 1-[(4-fluorophenyl)methyl]-N-hydroxy-N-methyl-3-[(3-oxopiperazin-1-yl)methyl]-
Database identifiers
- PubChem CID
- 11683012
- ChEMBL
CHEMBL1289200
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 90.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 630
Related reactions
2 records
Linked notes
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