N-(8-Nitroquinolin-4-yl)-N-(N,N-dimethylaminoethyl)-2-iodo-5,6-dimethoxybenzamide
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Basic information
- Standard SMILES
COc1ccc(I)c(C(=O)N(CCN(C)C)c2ccnc3c([N+](=O)[O-])cccc23)c1OC- InChIKey
JPDOVHIFENSBJB-UHFFFAOYSA-N- Molecular formula
- C22H23IN4O5
- Average molar mass
- 550.3 g/mol
Names & identifiers
- Preferred name
- N-(8-Nitroquinolin-4-yl)-N-(N,N-dimethylaminoethyl)-2-iodo-5,6-dimethoxybenzamide
- IUPAC
- N-[2-(dimethylamino)ethyl]-6-iodo-2,3-dimethoxy-N-(8-nitroquinolin-4-yl)benzamide
Names & synonyms
SCHEMBL4906843JPDOVHIFENSBJB-UHFFFAOYSA-NN-(8-Nitroquinolin-4-yl)-N-(N,N-dimethylaminoethyl)-2-iodo-5,6-dimethoxybenzamide
Database identifiers
- PubChem CID
- 69236752
Properties
Computed structural propertiesFilling in
- XLogP
- 3.7
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 648
Related reactions
1 records
Compound notes
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