ethyl 4-[[9-(2-furanylmethyl)-9H-purin-8-yl]amino]-1-piperidinecarboxylate
Basic information
- Standard SMILES
CCOC(=O)N1CCC(Nc2nc3cncnc3n2Cc2ccco2)CC1- InChIKey
VSGZBCRQJOPOHW-UHFFFAOYSA-N- Molecular formula
- C18H22N6O3
- Average molar mass
- 370.4 g/mol
Names & identifiers
- Preferred name
- ethyl 4-[[9-(2-furanylmethyl)-9H-purin-8-yl]amino]-1-piperidinecarboxylate
- IUPAC
- ethyl 4-[[9-(furan-2-ylmethyl)purin-8-yl]amino]piperidine-1-carboxylate
Names & synonyms
SCHEMBL9564816VSGZBCRQJOPOHW-UHFFFAOYSA-Nethyl 4-[[9-(2-furanylmethyl)-9H-purin-8-yl]amino]-1-piperidinecarboxylate
Database identifiers
- PubChem CID
- 19785341
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 98.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 501
Related reactions
3 records
Compound notes
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