Completing data — usually done within a minute
Basic information
- CAS
895519-81-0- Standard SMILES
Cc1ncc(N)cc1Nc1nccc(-c2cccnc2)n1- InChIKey
DGTFTSBJDCCWPD-UHFFFAOYSA-N- Molecular formula
- C15H14N6
- Average molar mass
- 278.31 g/mol
Names & identifiers
- Preferred name
- 2-Methyl-N3-(4-(pyridin-3-yl)pyriMidin-2-yl)pyridine-3,5-diaMine
- IUPAC
- 2-methyl-3-N-(4-pyridin-3-ylpyrimidin-2-yl)pyridine-3,5-diamine
Names & synonyms
895519-81-02-Methyl-N3-(4-(pyridin-3-yl)pyriMidin-2-yl)pyridine-3,5-diaMineFlumatinib metabolite M48N9JY3GCL12-methyl-3-N-(4-pyridin-3-ylpyrimidin-2-yl)pyridine-3,5-diamine2-Methyl-N3-(4-(3-pyridinyl)-2-pyrimidinyl)-3,5-pyridinediamine3,5-Pyridinediamine, 2-methyl-N3-(4-(3-pyridinyl)-2-pyrimidinyl)-2-methyl-N3-[4-(pyridin-3-yl)pyrimidin-2-yl]pyridine-3,5-diaminestarbld0046900UNII-8N9JY3GCL1SCHEMBL3004681SCHEMBL29912657
Show more names
DGTFTSBJDCCWPD-UHFFFAOYSA-NSB17970DB-3386262-Methyl-N3-(4-pyridin-3-yl-pyrimidin-2-yl)-pyridine-3,5-diamineN-(5-amino-2-methylpyrid-3-yl)-4-(pyrid-3-yl)-2-pyrimidinamineN-(5-amino-2-methylpyridin-3-yl)-4-(3-pyridyl)pyrimidin-2-amine
Database identifiers
- CAS
895519-81-0- PubChem CID
- 46909856
- UNII
- 8N9JY3GCL1
Properties
Computed structural propertiesFilling in
- XLogP
- 1.3
- Topological polar surface area
- 89.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 325
Related reactions
11 records
Compound notes
Loading…