Basic information
- Standard SMILES
Cc1cc(Br)cc(Nc2nccc(C)n2)c1- InChIKey
UPNUBFXGVUTGGF-UHFFFAOYSA-N- Molecular formula
- C12H12BrN3
- Average molar mass
- 278.15 g/mol
Names & identifiers
- Preferred name
- N-(3-bromo-5-methylphenyl)-4-methylpyrimidin-2-amine
- IUPAC
- N-(3-bromo-5-methylphenyl)-4-methylpyrimidin-2-amine
Names & synonyms
N-(3-bromo-5-methylphenyl)-4-methylpyrimidin-2-amine1312535-22-0N-(3-bromo-5-methylphenyl)-4-methyl-2-PyrimidinamineSCHEMBL2017502UPNUBFXGVUTGGF-UHFFFAOYSA-NMFCD26403266DA-12651WS-00699W15189
Database identifiers
- PubChem CID
- 67249356
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 37.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 224
Related reactions
3 records
Compound notes
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