[4-(8-Bromo-2-oxo-2,3-dihydro-imidazo[4,5-c]quinolin-1-yl)-3-methyl-pyrazol-1-yl]-acetic acid methyl ester
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
COC(=O)Cn1cc(-n2c(=O)[nH]c3cnc4ccc(Br)cc4c32)c(C)n1- InChIKey
VXBJOLFSZZMNKP-UHFFFAOYSA-N- Molecular formula
- C17H14BrN5O3
- Average molar mass
- 416.2 g/mol
Names & identifiers
- Preferred name
- [4-(8-Bromo-2-oxo-2,3-dihydro-imidazo[4,5-c]quinolin-1-yl)-3-methyl-pyrazol-1-yl]-acetic acid methyl ester
- IUPAC
- methyl 2-[4-(8-bromo-2-oxo-3H-imidazo[4,5-c]quinolin-1-yl)-3-methylpyrazol-1-yl]acetate
Names & synonyms
SCHEMBL3516333VXBJOLFSZZMNKP-UHFFFAOYSA-N[4-(8-bromo-2-oxo-2,3-dihydro-imidazo[4,5-c]quinolin-1-yl)-3-methyl-pyrazol-1-yl]-acetic acid methyl ester
Database identifiers
- PubChem CID
- 59620049
Properties
Computed structural propertiesFilling in
- XLogP
- 2
- Topological polar surface area
- 89.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 579
Related reactions
4 records
Compound notes
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