Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCN(c2cnc(-c3nc(C4(c5ccc(-c6cnc(N)nc6)nc5)CCC4)no3)cn2)CC1- InChIKey
ZTEOUUSHYMVQTI-UHFFFAOYSA-N- Molecular formula
- C28H32N10O3
- Average molar mass
- 556.6 g/mol
Names & identifiers
- Preferred name
- Tert-butyl 4-[5-[3-[1-[6-(2-aminopyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazin-2-yl]piperazine-1-carboxylate
- IUPAC
- tert-butyl 4-[5-[3-[1-[6-(2-aminopyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazin-2-yl]piperazine-1-carboxylate
Names & synonyms
SCHEMBL881996
Database identifiers
- PubChem CID
- 66828362
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 162 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 7
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 885
Related reactions
1 records
Compound notes
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