Basic information
- Standard SMILES
COc1cc2ncnc(N3CCN(C(=O)Nc4ccccc4)CC3)c2cc1OC- InChIKey
IOBJUORGEFFXQH-UHFFFAOYSA-N- Molecular formula
- C21H23N5O3
- Average molar mass
- 393.4 g/mol
- Monoisotopic mass
- 393.18008961
Names & identifiers
- Preferred name
- 4-(6,7-Dimethoxy-4-quinazolinyl)-N-phenyl-1-piperazinecarboxamide
- IUPAC
- 4-(6,7-dimethoxyquinazolin-4-yl)-N-phenylpiperazine-1-carboxamide
Names & synonyms
CHEMBL316770SCHEMBL2922350IOBJUORGEFFXQH-UHFFFAOYSA-NBDBM501153034-(6,7-Dimethoxy-4-quinazolinyl)-N-phenyl-1-piperazinecarboxamide4-(6,7-Dimethoxy-quinazolin-4-yl)-piperazine-1-carboxylic acid phenylamide
Database identifiers
- PubChem CID
- 11036639
- ChEMBL
CHEMBL316770
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 79.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 536
Related reactions
4 records
Compound notes
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