Basic information
- Standard SMILES
COc1nc2ccc(C)cc2nc1NC(=O)N1CCN(c2ccccc2Cl)CC1- InChIKey
AJZUNQSALUODQG-UHFFFAOYSA-N- Molecular formula
- C21H22ClN5O2
- Average molar mass
- 411.9 g/mol
- Monoisotopic mass
- 411.1462027
Names & identifiers
- Preferred name
- 1-[(2-Methoxy-6-methylquinoxalin-3-yl)aminocarbonyl]-4-(2-chlorophenyl)piperazine
- IUPAC
- 4-(2-chlorophenyl)-N-(3-methoxy-7-methylquinoxalin-2-yl)piperazine-1-carboxamide
Names & synonyms
SCHEMBL1138457AJZUNQSALUODQG-UHFFFAOYSA-N1-[(2-Methoxy-6-methylquinoxalin-3-yl)aminocarbonyl]-4-(2-chlorophenyl)piperazine
Database identifiers
- PubChem CID
- 66918201
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 70.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 559
Related reactions
3 records
Compound notes
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