Basic information
- CAS
70203-80-4- Standard SMILES
C1CNCCN1.CC(C(=O)O)n1c(-c2ccccc2)nc2ccccc2c1=O.CC(C(=O)O)n1c(-c2ccccc2)nc2ccccc2c1=O- InChIKey
YPLMERKJRJOFGD-UHFFFAOYSA-N- Molecular formula
- C38H38N6O6
- Average molar mass
- 674.7 g/mol
- Monoisotopic mass
- 674.28528295
Names & identifiers
- Preferred name
- 2-(4-Oxo-2-phenylquinazolin-3(4H)-yl)propanoic acid--piperazine (2/1)
- IUPAC
- bis(2-(4-oxo-2-phenylquinazolin-3-yl)propanoic acid);piperazine
Names & synonyms
70203-80-4DTXSID909904412-(4-Oxo-2-phenylquinazolin-3(4H)-yl)propanoic acid--piperazine (2/1)RefChem:1061335DTXCID001417543Piperazine, bis(alpha-methyl-4-oxo-2-phenyl-3(4H)-quinazolineacetate)
Database identifiers
- CAS
70203-80-4- PubChem CID
- 3053643
- DTXSID
DTXSID90990441
Properties
Computed structural properties
- Topological polar surface area
- 164 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 6
- Heavy atoms
- 50
- Formal charge
- 0
- Complexity
- 509
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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