4-[2-(2-Aminopyrimidin-5-yl)-9-(2-methylpropyl)-6-morpholin-4-ylpurin-8-yl]-2-methylpiperazine-1-carbaldehyde
Basic information
- Standard SMILES
CC(C)Cn1c(N2CCN(C=O)C(C)C2)nc2c(N3CCOCC3)nc(-c3cnc(N)nc3)nc21- InChIKey
IYUHQIRXJWMJSV-UHFFFAOYSA-N- Molecular formula
- C23H32N10O2
- Average molar mass
- 480.6 g/mol
Names & identifiers
- Preferred name
- 4-[2-(2-Aminopyrimidin-5-yl)-9-(2-methylpropyl)-6-morpholin-4-ylpurin-8-yl]-2-methylpiperazine-1-carbaldehyde
- IUPAC
- 4-[2-(2-aminopyrimidin-5-yl)-9-(2-methylpropyl)-6-morpholin-4-ylpurin-8-yl]-2-methylpiperazine-1-carbaldehyde
Names & synonyms
SCHEMBL13383060
Database identifiers
- PubChem CID
- 75112380
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 5
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 702
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Related reactions
1 records
Compound notes
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