Basic information
- Standard SMILES
COc1cc2ncnc(Oc3ccc(NC(=S)NCCCN4CCCC4)cc3)c2cc1OC- InChIKey
SYQQEQQXXSZLTF-UHFFFAOYSA-N- Molecular formula
- C24H29N5O3S
- Average molar mass
- 467.6 g/mol
Names & identifiers
- Preferred name
- N-{4-[(6,7-Dimethoxy-4-quinazolinyl)oxy]phenyl}-N'-[3-(1-pyrrolidinyl)propyl]thiourea
- IUPAC
- 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-3-(3-pyrrolidin-1-ylpropyl)thiourea
Names & synonyms
SCHEMBL5824477SYQQEQQXXSZLTF-UHFFFAOYSA-NN-{4-[(6,7-Dimethoxy-4-quinazolinyl)-oxy]phenyl}-N'-[3-(1-pyrrolidinyl)propyl]thioureaN-{4-[(6,7-Dimethoxy-4-quinazolinyl)oxy]phenyl}-N'-[3-(1-pyrrolidinyl)propyl]thiourea
Database identifiers
- PubChem CID
- 21890673
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 601
Related reactions
1 records
Compound notes
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