Basic information
- Standard SMILES
COc1cc2c(NC(=O)NC3CC3c3ccccc3)ncnc2cc1OCC1CCN(C)CC1- InChIKey
SOTBAUFKICPGMQ-UHFFFAOYSA-N- Molecular formula
- C26H31N5O3
- Average molar mass
- 461.6 g/mol
- Monoisotopic mass
- 461.24268987
Names & identifiers
- Preferred name
- 1-[6-Methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-yl]-3-(2-phenylcyclopropyl)urea
- IUPAC
- 1-[6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-yl]-3-(2-phenylcyclopropyl)urea
Names & synonyms
SCHEMBL5497167
Database identifiers
- PubChem CID
- 22649201
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 88.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 667
Related reactions
1 records
Compound notes
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