Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
Cl.Cn1ncc2c1Nc1ccccc1N(C(=O)c1ccc(CN)cc1F)C2- InChIKey
AFQQMHGNTRFGLX-UHFFFAOYSA-N- Molecular formula
- C19H19ClFN5O
- Average molar mass
- 387.8 g/mol
Names & identifiers
- Preferred name
- (4-Aminomethyl-2-fluoro-phenyl)-(3-methyl-4,10-dihydro-3H-2,3,4,9-tetraaza-benzo[f]azulen-9-yl)-methanone Hydrochloride
- IUPAC
- [4-(aminomethyl)-2-fluorophenyl]-(1-methyl-4,10-dihydropyrazolo[4,5-c][1,5]benzodiazepin-5-yl)methanone;hydrochloride
Names & synonyms
SCHEMBL2131142AFQQMHGNTRFGLX-UHFFFAOYSA-N(4-Aminomethyl-2-fluoro-phenyl)-(3-methyl-4,10-dihydro-3H-2,3,4,9-tetraaza-benzo[f]azulen-9-yl)-methanone Hydrochloride
Database identifiers
- PubChem CID
- 136346643
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 76.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 520
Related reactions
2 records
Compound notes
Loading…