Basic information
- Standard SMILES
COc1cc(OC)c2c(=O)[nH]c(-c3cc(C)c(CCCN4CCCC4)c(C)c3)nc2c1- InChIKey
FEJDJUQINIRMBJ-UHFFFAOYSA-N- Molecular formula
- C25H31N3O3
- Average molar mass
- 421.5 g/mol
Names & identifiers
- Preferred name
- 2-(3,5-Dimethyl-4-(3-(pyrrolidin-1-yl)propyl)phenyl)-5,7-dimethoxyquinazolin-4(3H)-one
- IUPAC
- 2-[3,5-dimethyl-4-(3-pyrrolidin-1-ylpropyl)phenyl]-5,7-dimethoxy-3H-quinazolin-4-one
Names & synonyms
SCHEMBL377793FEJDJUQINIRMBJ-UHFFFAOYSA-N2-(3,5-Dimethyl-4-(3-(pyrrolidin-1-yl)propyl)phenyl)-5,7-dimethoxyquinazolin-4(3H)-one
Database identifiers
- PubChem CID
- 136348010
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 63.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 636
Related reactions
1 records
Compound notes
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