Basic information
- Standard SMILES
O=C(c1ccc(-c2cnc3c(c2)N(Cc2c(F)ccc(F)c2Cl)CCN3)cc1)N1CCC(N2CCCC2)CC1- InChIKey
YNNDEJUPWVGWJK-UHFFFAOYSA-N- Molecular formula
- C30H32ClF2N5O
- Average molar mass
- 552.1 g/mol
Names & identifiers
- Preferred name
- {4-[1-(2-Chloro-3,6-difluorobenzyl)-1,2,3,4-tetrahydropyrido[2,3-b]pyrazin-7-yl]phenyl}-(4-(pyrrolidin-1-yl)piperidin-1-yl)methanone
- IUPAC
- [4-[1-[(2-chloro-3,6-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]phenyl]-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone
Names & synonyms
SCHEMBL1600272YNNDEJUPWVGWJK-UHFFFAOYSA-N{4-[1-(2-Chloro-3,6-difluorobenzyl)-1,2,3,4-tetrahydropyrido[2,3-b]pyrazin-7-yl]phenyl}-(4-(pyrrolidin-1-yl)piperidin-1-yl)methanone
Database identifiers
- PubChem CID
- 17755437
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 51.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 817
Related reactions
4 records
Compound notes
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