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Basic information
- Standard SMILES
Cc1cc(C)n2cc(CSc3nc(-c4ccccc4)cn3C)nc2n1- InChIKey
PHRXKMLPVHCGBS-UHFFFAOYSA-N- Molecular formula
- C19H19N5S
- Average molar mass
- 349.5 g/mol
- Monoisotopic mass
- 349.1361168
Names & identifiers
- Preferred name
- 5,7-dimethyl-2-((1-methyl-4-phenyl-1H-imidazol-2-ylthio)methyl)imidazo[1,2-a]pyrimidine
- IUPAC
- 5,7-dimethyl-2-[(1-methyl-4-phenylimidazol-2-yl)sulfanylmethyl]imidazo[1,2-a]pyrimidine
Names & synonyms
SCHEMBL259509CHEMBL3700112PHRXKMLPVHCGBS-UHFFFAOYSA-NBDBM1562585,7-dimethyl-2((1-methyl-4-phenyl-1H-imidazol-2-ylthio)methyl)imidazo[1,2-a]pyrimidine5,7-dimethyl-2-((1-methyl-4-phenyl-1H-imidazol-2-ylthio)methyl)imidazo[1,2-a]pyrimidineUS9018217, 5,7-dimethyl-2((1-methyl-4-phenyl-1H-imidazol-2-ylthio)methyl)imidazo[1,2-a]pyrimidine
Database identifiers
- PubChem CID
- 44548780
- ChEMBL
CHEMBL3700112
Properties
Computed structural propertiesFilling in
- XLogP
- 4
- Topological polar surface area
- 73.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 444
Related reactions
3 records
Compound notes
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