2-Methylpyrido[2,3-B]pyrazine-3(4H)-thione
Basic information
- CAS
115366-84-2- Standard SMILES
Cc1nc2cccnc2[nH]c1=S- InChIKey
CEQIQPGYHXGGQT-UHFFFAOYSA-N- Molecular formula
- C8H7N3S
- Average molar mass
- 177.23 g/mol
- Monoisotopic mass
- 177.03606841
Names & identifiers
- Preferred name
- 2-Methylpyrido[2,3-B]pyrazine-3(4H)-thione
- IUPAC
- 2-methyl-4H-pyrido[2,3-b]pyrazine-3-thione
- English name
- Pyrido[2,3-b]pyrazine-3(4H)-thione, 2-methyl- (9CI)
- Molecular formula
- C8H7N3S
- Molecular weight
- 177.23
Names & synonyms
115366-84-22-METHYLPYRIDO[2,3-B]PYRAZINE-3(4H)-THIONE2-METHYL-4H-PYRIDO[2,3-B]PYRAZINE-3-THIONEPyrido[2,3-b]pyrazine-3(4H)-thione, 2-methyl- (9CI)SCHEMBL9695148DTXSID50567471CEQIQPGYHXGGQT-UHFFFAOYSA-N3-mercapto-2-methylpyrido[2,3-b]pyrazinePyrido[2,3-b]pyrazine-3(4H)-thione, 2-methyl-
Database identifiers
- CAS
115366-84-2- PubChem CID
- 15045481
- DTXSID
DTXSID50567471
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 69.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 236
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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