Basic information
- CAS
126128-35-6- Standard SMILES
O=c1ncc2c([nH]1)NOCC2- InChIKey
OQCFWECOQNPQCG-UHFFFAOYSA-N- Molecular formula
- C6H7N3O2
- Average molar mass
- 153.14 g/mol
- Monoisotopic mass
- 153.05382648
Overview
structure given in first source
Names & identifiers
- Preferred name
- 6H,8H-3,4-dihydropyrimido(4,5-c)(1,2)oxazin-7-one
- IUPAC
- 1,3,4,8-tetrahydropyrimido[4,5-c]oxazin-7-one
- English name
- 6H,8H-3,4-dihydropyrimido(4,5-c)(1,2)oxazin-7-one
- Molecular formula
- C6H7N3O2
- Molecular weight
- 153.14
Names & synonyms
Base P6H,8H-3,4-Dihydropyrimido(4,5-c)(1,2)oxazin-7-one126128-35-6DTXSID20155086RefChem:105377DTXCID9077577SCHEMBL332702SCHEMBL5879672SCHEMBL63753224,8-dihydro-1H-pyrimido[4,5-c][1,2]oxazin-7(3H)-one3H-Pyrimido(4,5-c)(1,2)oxazin-7(1H)-one, 4,6-dihydro-1H-Pyrimido[4,5-c][1,2]oxazin-7(3H)-one, 4,8-dihydro-
Database identifiers
- CAS
126128-35-6- PubChem CID
- 130855
- DTXSID
DTXSID20155086- Nikkaji
- J673.259C
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 257
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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