9-Tetradecylpurin-6-amine
Basic information
- CAS
68180-29-0- Standard SMILES
CCCCCCCCCCCCCCn1cnc2c(N)ncnc21- InChIKey
RWRWNYMJLIMDIT-UHFFFAOYSA-N- Molecular formula
- C19H33N5
- Average molar mass
- 331.5 g/mol
- Monoisotopic mass
- 331.27359607
Names & identifiers
- Preferred name
- 9-Tetradecylpurin-6-amine
- IUPAC
- 9-tetradecylpurin-6-amine
Names & synonyms
9-tetradecylpurin-6-amine68180-29-0NSC2851269-Tetradecyl-9H-purin-6-amineDTXSID60314534NSC-285126DS-009476
Database identifiers
- CAS
68180-29-0- PubChem CID
- 323600
- DTXSID
DTXSID60314534
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 13
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 312
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Compound notes
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