Basic information
- Standard SMILES
COc1cc2nccc(Oc3cc(C)c(NC(=O)NCCN4CCCC4)cc3C)c2cc1OC- InChIKey
IVKMNOOVNXVIKA-UHFFFAOYSA-N- Molecular formula
- C26H32N4O4
- Average molar mass
- 464.6 g/mol
- Monoisotopic mass
- 464.24235551
Names & identifiers
- Preferred name
- N-{4-[(6,7-Dimethoxy-4-quinolyl)oxy]-2,5-dimethylphenyl}-N'-(2-tetrahydro-1H-1-pyrrolylethyl)urea
- IUPAC
- 1-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]-3-(2-pyrrolidin-1-ylethyl)urea
Names & synonyms
SCHEMBL5824544IVKMNOOVNXVIKA-UHFFFAOYSA-NN-{4-[(6,7-Dimethoxy-4-quinolyl)oxy]-2,5-dimethylphenyl}-N'-(2-tetrahydro-1H-1-pyrrolylethyl)urea
Database identifiers
- PubChem CID
- 21890148
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 85 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 646
Related reactions
2 records
Compound notes
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