Basic information
- Standard SMILES
COc1ccnc(-c2nnc3n2CCN(C(=O)c2ccc(Cl)c(F)c2Cl)C3)c1- InChIKey
UDLJEDMNPYHFKV-UHFFFAOYSA-N- Molecular formula
- C18H14Cl2FN5O2
- Average molar mass
- 422.2 g/mol
Names & identifiers
- Preferred name
- 7-[(2,4-Dichloro-3-fluorophenyl)carbonyl]-3-[4-(methyloxy)-2-pyridinyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine
- IUPAC
- (2,4-dichloro-3-fluorophenyl)-[3-(4-methoxy-2-pyridinyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]methanone
Names & synonyms
SCHEMBL110297UDLJEDMNPYHFKV-UHFFFAOYSA-N7-[(2,4-dichloro-3-fluorophenyl)carbonyl]-3-[4-(methyloxy)-2-pyridinyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine
Database identifiers
- PubChem CID
- 66599435
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 73.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 576
Related reactions
1 records
Compound notes
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