4-Quinazolinamine, 6,7-dimethoxy-2-(4-phenyl-1-piperazinyl)-
Basic information
- CAS
331258-43-6- Standard SMILES
COc1cc2nc(N3CCN(c4ccccc4)CC3)nc(N)c2cc1OC- InChIKey
MFIDHISLMOJQRL-UHFFFAOYSA-N- Molecular formula
- C20H23N5O2
- Average molar mass
- 365.4 g/mol
- Monoisotopic mass
- 365.18517499
Names & identifiers
- Preferred name
- 4-Quinazolinamine, 6,7-dimethoxy-2-(4-phenyl-1-piperazinyl)-
- IUPAC
- 6,7-dimethoxy-2-(4-phenylpiperazin-1-yl)quinazolin-4-amine
Names & synonyms
331258-43-6DTXSID803889544-Quinazolinamine, 6,7-dimethoxy-2-(4-phenyl-1-piperazinyl)-RefChem:296203DTXCID902001786,7-dimethoxy-2-(4-phenylpiperazin-1-yl)quinazolin-4-amineCHEMBL511930SCHEMBL14095306
Database identifiers
- CAS
331258-43-6- PubChem CID
- 3076906
- DTXSID
DTXSID80388954- ChEMBL
CHEMBL511930- Nikkaji
- J1.608.891I
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 467
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Compound notes
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