6-chloro-N-propan-2-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine
Basic information
- CAS
5413-83-2- Standard SMILES
CC(C)Nc1nc(Cl)nc2[nH]ncc12- InChIKey
UVOFBPCMAFXYNV-UHFFFAOYSA-N- Molecular formula
- C8H10ClN5
- Average molar mass
- 211.65 g/mol
- Monoisotopic mass
- 211.062473
Names & identifiers
- Preferred name
- 6-chloro-N-propan-2-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine
- IUPAC
- 6-chloro-N-propan-2-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine
Names & synonyms
5413-83-2NSC7846DTXSID10969033NSC-78466-Chloro-N-(propan-2-yl)-1,2-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-imine
Database identifiers
- CAS
5413-83-2- PubChem CID
- 222235
- DTXSID
DTXSID10969033
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 200
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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