1-(3-(4-methoxybenzyl)-3H-imidazo[4,5-c]pyridin-6-yl)ethanone oxime
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Basic information
- Standard SMILES
COc1ccc(Cn2cnc3cc(C(C)=NO)ncc32)cc1- InChIKey
XNOCPWFARFABKA-UHFFFAOYSA-N- Molecular formula
- C16H16N4O2
- Average molar mass
- 296.32 g/mol
- Monoisotopic mass
- 296.12732577
Names & identifiers
- Preferred name
- 1-(3-(4-methoxybenzyl)-3H-imidazo[4,5-c]pyridin-6-yl)ethanone oxime
- IUPAC
- N-[1-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-c]pyridin-6-yl]ethylidene]hydroxylamine
Names & synonyms
SCHEMBL15091323XNOCPWFARFABKA-UHFFFAOYSA-N1-(3-(4-methoxybenzyl)-3H-imidazo[4,5-c]pyridin-6-yl)ethanone oxime
Database identifiers
- PubChem CID
- 136409102
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 72.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 396
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Related reactions
2 records
Compound notes
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