4-[2-(difluoromethyl)-1H-benzimidazol-1-yl]-6-(4-morpholinyl)-N-(3-pyridazinyl)-1,3,5-triazin-2-amine
Basic information
- Standard SMILES
FC(F)c1nc2ccccc2n1-c1nc(Nc2cccnn2)nc(N2CCOCC2)n1- InChIKey
WSXRYXONBWEJEB-UHFFFAOYSA-N- Molecular formula
- C19H17F2N9O
- Average molar mass
- 425.4 g/mol
Names & identifiers
- Preferred name
- 4-[2-(difluoromethyl)-1H-benzimidazol-1-yl]-6-(4-morpholinyl)-N-(3-pyridazinyl)-1,3,5-triazin-2-amine
- IUPAC
- 4-[2-(difluoromethyl)benzimidazol-1-yl]-6-morpholin-4-yl-N-pyridazin-3-yl-1,3,5-triazin-2-amine
Names & synonyms
4-[2-(difluoromethyl)-1H-benzimidazol-1-yl]-6-(4-morpholinyl)-N-(3-pyridazinyl)-1,3,5-triazin-2-amineSCHEMBL952509
Database identifiers
- PubChem CID
- 49869355
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 585
Related reactions
2 records
Compound notes
Loading…