2-(3-Hydroxypropyl)-2H-pyrazolo[4,3-d]pyrimidin-7(6H)-one
Basic information
- CAS
923283-91-4- Standard SMILES
O=c1[nH]cnc2cn(CCCO)nc12- InChIKey
ZGPUCHWPSHUMCI-UHFFFAOYSA-N- Molecular formula
- C8H10N4O2
- Average molar mass
- 194.19 g/mol
- Monoisotopic mass
- 194.08037557
Names & identifiers
- Preferred name
- 2-(3-Hydroxypropyl)-2H-pyrazolo[4,3-d]pyrimidin-7(6H)-one
- IUPAC
- 2-(3-hydroxypropyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one
Names & synonyms
923283-91-42-(3-Hydroxypropyl)-2H-pyrazolo[4,3-d]pyrimidin-7(6H)-one2-(3-hydroxypropyl)-2H,6H,7H-pyrazolo[4,3-d]pyrimidin-7-oneSCHEMBL12725315DTXSID007382552-(3-Hydroxypropyl)-2,4-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Database identifiers
- CAS
923283-91-4- PubChem CID
- 136257902
- DTXSID
DTXSID00738255
Properties
Computed structural properties
- XLogP
- -1
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 256
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Compound notes
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