Basic information
- Standard SMILES
Cc1ccc2c(c1)c(=O)n(C1CCN(c3ncnc4cc(OCc5ccccc5)c(OCc5ccccc5)cc34)CC1)c(=O)n2C- InChIKey
AIIQXJFJUDDZDE-UHFFFAOYSA-N- Molecular formula
- C37H35N5O4
- Average molar mass
- 613.7 g/mol
- Monoisotopic mass
- 613.26890461
Names & identifiers
- Preferred name
- 3-[1-(6,7-Dibenzyloxy-4-quinazolinyl)-4-piperidinyl]-1,2,3,4-tetrahydro-1,6-dimethyl-2,4-dioxoquinazoline
- IUPAC
- 3-[1-[6,7-bis(phenylmethoxy)quinazolin-4-yl]piperidin-4-yl]-1,6-dimethylquinazoline-2,4-dione
Names & synonyms
SCHEMBL8857741AIIQXJFJUDDZDE-UHFFFAOYSA-N3-[1-(6,7-Dibenzyloxy-4-quinazolinyl)-4-piperidinyl]-1,2,3,4-tetrahydro-1,6-dimethyl-2,4-dioxoquinazoline
Database identifiers
- PubChem CID
- 22923488
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 88.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 1,030
Related reactions
7 records
Compound notes
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