Basic information
- Standard SMILES
O=C(Nc1ccc(C(=O)c2c[nH]c3ncccc23)cn1)c1ccc(C(F)(F)F)cc1- InChIKey
AXUXJHPAXYISIR-UHFFFAOYSA-N- Molecular formula
- C21H13F3N4O2
- Average molar mass
- 410.3 g/mol
Names & identifiers
- Preferred name
- N-[5-(1H-Pyrrolo[2,3-b]pyridine-3-carbonyl)-pyridin-2-yl]-4-trifluoromethyl-benzamide
- IUPAC
- N-[5-(1H-pyrrolo[2,3-b]pyridine-3-carbonyl)-2-pyridinyl]-4-(trifluoromethyl)benzamide
Names & synonyms
N-[5-(1H-Pyrrolo[2,3-b]pyridine-3-carbonyl)-pyridin-2-yl]-4-trifluoromethyl-benzamideSCHEMBL1267423
Database identifiers
- PubChem CID
- 59593286
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 87.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 636
Related reactions
3 records
Compound notes
Loading…