Basic information
- Standard SMILES
CN1CCN(C(=O)c2ccc(-c3cnc4c(n3)N(Cc3c(F)ccc(F)c3Cl)CCN4)cc2)CC1- InChIKey
HLHGXWPMXNKQKA-UHFFFAOYSA-N- Molecular formula
- C25H25ClF2N6O
- Average molar mass
- 499 g/mol
Names & identifiers
- Preferred name
- {4-[8-(2-Chloro-3,6-difluorobenzyl)-5,6,7,8-tetrahydropyrazino[2,3-b]pyrazin-2-yl]phenyl}(4-methylpiperazin-1-yl)methanone
- IUPAC
- [4-[5-[(2-chloro-3,6-difluorophenyl)methyl]-7,8-dihydro-6H-pyrazino[2,3-b]pyrazin-3-yl]phenyl]-(4-methylpiperazin-1-yl)methanone
Names & synonyms
SCHEMBL1369722HLHGXWPMXNKQKA-UHFFFAOYSA-N{4-[8-(2-chloro-3,6-difluorobenzyl)-5,6,7,8-tetrahydropyrazino[2,3-b]pyrazin-2-yl]phenyl}(4-methylpiperazin-1-yl)methanone
Database identifiers
- PubChem CID
- 67008447
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 720
Related reactions
1 records
Compound notes
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