Basic information
- Standard SMILES
Cc1nn(-c2ccccc2)c(C)c1CN1CCN(c2nccnc2-c2ccc(Cl)c(Cl)c2)CC1.Cl- InChIKey
RORDVUXDRPTWDJ-UHFFFAOYSA-N- Molecular formula
- C26H27Cl3N6
- Average molar mass
- 529.9 g/mol
Names & identifiers
- Preferred name
- 3'-(3,4-Dichloro-phenyl)-4-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-ylmethyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyrazinyl hydrochloride
- IUPAC
- 2-(3,4-dichlorophenyl)-3-[4-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine;hydrochloride
Names & synonyms
SCHEMBL3324349RORDVUXDRPTWDJ-UHFFFAOYSA-N3'-(3,4-Dichloro-phenyl)-4-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-ylmethyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyrazinyl hydrochloride
Database identifiers
- PubChem CID
- 68596117
Properties
Computed structural properties
- Topological polar surface area
- 50.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 641
Related reactions
1 records
Compound notes
Loading…