2-(3-Methyl-1-phenyl-1H-pyrazolo(3,4-b)pyridin-5-yl)benzenamine
Basic information
- CAS
1195785-13-7- Standard SMILES
Cc1nn(-c2ccccc2)c2ncc(-c3ccccc3N)cc12- InChIKey
ZFYKIAFJHGVGDV-UHFFFAOYSA-N- Molecular formula
- C19H16N4
- Average molar mass
- 300.4 g/mol
- Monoisotopic mass
- 300.13749653
Names & identifiers
- Preferred name
- 2-(3-Methyl-1-phenyl-1H-pyrazolo(3,4-b)pyridin-5-yl)benzenamine
- IUPAC
- 2-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)aniline
Names & synonyms
2-(3-Methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-5-yl)benzenamine1195785-13-72-(3-Methyl-1-phenyl-1H-pyrazolo(3,4-b)pyridin-5-yl)benzenamineRefChem:251637DTXSID3011745922-(3-Methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-5-yl)aniline
Database identifiers
- CAS
1195785-13-7- PubChem CID
- 44542532
- DTXSID
DTXSID301174592
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 56.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 395
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…