Basic information
- CAS
63012-78-2- Standard SMILES
O=c1nc2n(c3nccnc13)CCS2- InChIKey
QHJOAOQRUATIPC-UHFFFAOYSA-N- Molecular formula
- C8H6N4OS
- Average molar mass
- 206.23 g/mol
- Monoisotopic mass
- 206.026232
Names & identifiers
- Preferred name
- 8,9-Dihydro-5H-[1,3]thiazolo[3,2-a]pteridin-5-one
- IUPAC
- 8,9-dihydro-[1,3]thiazolo[3,2-a]pteridin-5-one
Names & synonyms
63012-78-2NSC2944268,9-Dihydro-5H-[1,3]thiazolo[3,2-a]pteridin-5-oneDTXSID40315408NSC-294426
Database identifiers
- CAS
63012-78-2- PubChem CID
- 325534
- DTXSID
DTXSID40315408
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 306
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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