3-methyl[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
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Basic information
- CAS
68774-82-3- Standard SMILES
Cc1nnc2c(=O)[nH]ccn12- InChIKey
QFGHYWRMIDUWNV-UHFFFAOYSA-N- Molecular formula
- C6H6N4O
- Average molar mass
- 150.14 g/mol
- Monoisotopic mass
- 150.05416083
Names & identifiers
- Preferred name
- 3-methyl[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
- IUPAC
- 3-methyl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one
Names & synonyms
68774-82-33-methyl-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-8-one3-methyl[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one3-methyl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-oneNSC293354SCHEMBL18519546DTXSID30315235AKOS017518702AKOS026674567BS-3828NSC-293354EN300-265359
Show more names
3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-ol3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-oneF1907-0274
Database identifiers
- CAS
68774-82-3- PubChem CID
- 325201
- DTXSID
DTXSID30315235
Properties
Computed structural propertiesFilling in
- XLogP
- -0.7
- Topological polar surface area
- 59.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 215
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Compound notes
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