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6-Phenylbenzo[4,5]imidazo[1,2-c]quinazoline

HCID 626477
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Basic information

CAS
28381-92-2
Standard SMILES
c1ccc(-c2nc3ccccc3c3nc4ccccc4n23)cc1
InChIKey
CJXRQYFQNGCDJA-UHFFFAOYSA-N
Molecular formula
C20H13N3
Average molar mass
295.3 g/mol
Monoisotopic mass
295.11094743

Names & identifiers

Preferred name
6-Phenylbenzo[4,5]imidazo[1,2-c]quinazoline
IUPAC
6-phenylbenzimidazolo[1,2-c]quinazoline
English name
6-PhenylbenziMidazo[1,2-c]quinazoline
Molecular formula
C20H13N3
Molecular weight
295.34

Names & synonyms

28381-92-26-Phenylbenzo[4,5]imidazo[1,2-c]quinazoline6-Phenyl-benzimidazol(1,2-c)quinazoline6-phenylbenzimidazolo[1,2-c]quinazolineMFCD003942286-Phenylbenzimidazo[1,2-c]quinazolineCHEMBL5584496-Phenyl-benzimidazo[1,2-c]quinazolineMLS000589913SCHEMBL12145678DTXSID30347839CJXRQYFQNGCDJA-UHFFFAOYSA-N
Show more names
BenziMidazo[1,2-c]quinazoline, 6-phenyl-Benzimidazo[1,2-c]quinazoline, 6-phenyl- (7CI,8CI,9CI)
HMS2523F06STK387457AKOS0013868086-Phenylbenzimidazo[1,2-c]quinazoline #BS-27819SMR000217072DB-369373CS-0213031

Database identifiers

CAS
28381-92-2
PubChem CID
626477
DTXSID
DTXSID30347839
ChEMBL
CHEMBL558449
Nikkaji
J1.140.542H

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
30.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
23
Formal charge
0
Complexity
419

Physicochemical properties

Melting point
231 · 231-233 °C(Solv: ethanol (64-17-5); ligroine (8032-32-4))
Density
1.27 · 1.27±0.1 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
2.62 · 2.62±0.30(Predicted)

Chemistry & industry

Applications

Uses6-Phenylbenzimidazolo[1,2-c]quinazoline, is a quinazoline derivative that can be used as in the preparation of polymers.

Related reactions

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Compound notes

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