Basic information
- Standard SMILES
CCOC(=O)CCC1CC(N(CC2OC(n3cnc4c(N)ncnc43)C3OC(C)(C)OC23)C(C)C)C1- InChIKey
CDQHSADZFIYIBR-UHFFFAOYSA-N- Molecular formula
- C25H38N6O5
- Average molar mass
- 502.6 g/mol
Names & identifiers
- Preferred name
- Ethyl 3-[3-[[4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl-propan-2-ylamino]cyclobutyl]propanoate
- IUPAC
- ethyl 3-[3-[[4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl-propan-2-ylamino]cyclobutyl]propanoate
Database identifiers
- PubChem CID
- 77353030
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 10
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 780
Related reactions
1 records
Compound notes
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