5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol

C28H18FN3O — CID 139235838

IUPAC5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol
SMILESOc1ccc2nc(-c3ccc(F)cc3)n3c(-c4ccccc4)c(-c4ccccc4)nc3c2c1
InChIInChI=1S/C28H18FN3O/c29-21-13-11-20(12-14-21)27-30-24-16-15-22(33)17-23(24)28-31-25(18-7-3-1-4-8-18)26(32(27)28)19-9-5-2-6-10-19/h1-17,33H
InChIKeyHMAQVIDCUHYMFZ-UHFFFAOYSA-N
MW431.47 g/mol
LogP6.73
Rot. Bonds3

About 5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol

5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol (PubChem CID 139235838) has the molecular formula C28H18FN3O and a molecular weight of 431.47 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol.

Molecular Properties

Compound Name5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol
PubChem CID139235838
Molecular FormulaC28H18FN3O
Molecular Weight431.47 g/mol
Exact Mass431.14
IUPAC Name5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol
SMILESOc1ccc2nc(-c3ccc(F)cc3)n3c(-c4ccccc4)c(-c4ccccc4)nc3c2c1
InChIInChI=1S/C28H18FN3O/c29-21-13-11-20(12-14-21)27-30-24-16-15-22(33)17-23(24)28-31-25(18-7-3-1-4-8-18)26(32(27)28)19-9-5-2-6-10-19/h1-17,33H
InChIKeyHMAQVIDCUHYMFZ-UHFFFAOYSA-N
XLogP6.73
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500431.47
LogP ≤ 56.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-phenyl-1H-benzo[d]imidazol-1-yl)phenol
CID 44405888
4-[[2-(2-Fluorophenyl)quinazolin-4-yl]amino]phenol
CID 2174842
4-(Methyl-phenyl-amino)-2-o-tolylamino-quinazolin-6-ol
CID 10405976
2-(4-Fluoro-2-methyl-phenylamino)-4-(methyl-phenyl-amino)-quinazolin-6-ol
CID 11740120
4-[1-(4-Fluorophenyl)-2-methylimidazo[4,5-c]quinolin-8-yl]phenol
CID 168287758
4-[2-(4-Fluorophenyl)benzimidazol-1-yl]phenol
CID 155544420
3-(12-Cyclopropyl-7-methyl-2,4,5,8,13-pentazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaen-3-yl)-4-fluorophenol
CID 73052327
4-Fluoro-3-(7-methyl-12-propan-2-yl-2,4,5,8,13-pentazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaen-3-yl)phenol
CID 89968297
2-Fluoro-5-[2-methyl-1-(1-methylpiperidin-4-yl)imidazo[4,5-c]quinolin-8-yl]phenol
CID 168278577
9-Hydroxy-5,11-dimethyl-5h-indolo[2,3-b]quinoline
CID 378355
3-Methyl-4-[4-(methyl-phenyl-amino)-quinazolin-2-ylamino]-phenol
CID 10428354
3-[(4-Amino-2-butylimidazo[4,5-c]quinolin-1-yl)methyl]phenol
CID 147146913

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol?
The IUPAC name of 5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol (CID 139235838) is 5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol.
What is the SMILES notation for 5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol?
The canonical SMILES for 5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol is Oc1ccc2nc(-c3ccc(F)cc3)n3c(-c4ccccc4)c(-c4ccccc4)nc3c2c1.
What is the InChIKey of 5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol?
The InChIKey is HMAQVIDCUHYMFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H18FN3O/c29-21-13-11-20(12-14-21)27-30-24-16-15-22(33)17-23(24)28-31-25(18-7-3-1-4-8-18)26(32(27)28)19-9-5-2-6-10-19/h1-17,33H.
What are the key properties of 5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol?
5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol has a molecular weight of 431.47 g/mol, XLogP of 6.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-2,3-diphenylimidazo[1,2-c]quinazolin-9-ol is sourced from PubChem (CID 139235838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).