4-{7-[2-(4-Methyl-piperazin-1-yl)-pyrimidin-5-yl]-imidazo[1,2-a]pyridin-3-yl}-phenylamine
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Basic information
- Standard SMILES
CN1CCN(c2ncc(-c3ccn4c(-c5ccc(N)cc5)cnc4c3)cn2)CC1- InChIKey
GKIJBJDHNPMZOT-UHFFFAOYSA-N- Molecular formula
- C22H23N7
- Average molar mass
- 385.5 g/mol
- Monoisotopic mass
- 385.20149376
Names & identifiers
- Preferred name
- 4-{7-[2-(4-Methyl-piperazin-1-yl)-pyrimidin-5-yl]-imidazo[1,2-a]pyridin-3-yl}-phenylamine
- IUPAC
- 4-[7-[2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]imidazo[1,2-a]pyridin-3-yl]aniline
Names & synonyms
SCHEMBL3189331GKIJBJDHNPMZOT-UHFFFAOYSA-N4-{7-[2-(4-methyl-piperazin-1-yl)-pyrimidin-5-yl]-imidazo[1,2-a]pyridin-3-yl}-phenylamine
Database identifiers
- PubChem CID
- 68543232
Properties
Computed structural propertiesFilling in
- XLogP
- 2.9
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 521
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Related reactions
7 records
Compound notes
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