9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline

C16H10BrClIN3 — CID 132516663

IUPAC9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline
SMILESClc1ccc(C2=Nc3c(I)cc(Br)cc3C3=NCCN23)cc1
InChIInChI=1S/C16H10BrClIN3/c17-10-7-12-14(13(19)8-10)21-15(22-6-5-20-16(12)22)9-1-3-11(18)4-2-9/h1-4,7-8H,5-6H2
InChIKeyZOALOPKQTSMHIP-UHFFFAOYSA-N
MW486.54 g/mol
LogP4.86
Rot. Bonds1

About 9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline

9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline (PubChem CID 132516663) has the molecular formula C16H10BrClIN3 and a molecular weight of 486.54 g/mol. Its IUPAC name is 9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline.

Molecular Properties

Compound Name9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline
PubChem CID132516663
Molecular FormulaC16H10BrClIN3
Molecular Weight486.54 g/mol
Exact Mass484.88
IUPAC Name9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline
SMILESClc1ccc(C2=Nc3c(I)cc(Br)cc3C3=NCCN23)cc1
InChIInChI=1S/C16H10BrClIN3/c17-10-7-12-14(13(19)8-10)21-15(22-6-5-20-16(12)22)9-1-3-11(18)4-2-9/h1-4,7-8H,5-6H2
InChIKeyZOALOPKQTSMHIP-UHFFFAOYSA-N
XLogP4.86
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500486.54
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

1-(4-chlorophenyl)-2-[4-[1-(4-chlorophenyl)-4,5-dihydroimidazol-2-yl]phenyl]-4,5-dihydroimidazole
CID 155551139
1-(4-chlorophenyl)-2-(2,4-dichlorophenyl)-4,5-dihydroimidazole
CID 141142984
5-chloro-17-(4-methylphenyl)-8,13,16,18-tetrazatetracyclo[9.7.0.02,7.012,16]octadeca-1(11),2(7),3,5,12,17-hexaene
CID 139226380
9-iodo-5-methyl-2,3-dihydroimidazo[1,2-c]quinazoline
CID 10662788
1-bromo-4-[4-(4-chlorophenyl)phenyl]benzene
CID 151204294
1,6-bis(4-chlorophenyl)-8-pyridin-4-yl-3,4-dihydropyrrolo[1,2-a]pyrazine
CID 139069277
1-bromo-4-chlorobenzene
CID 7806
5-[4-[(2,4-dichlorophenyl)methoxy]phenyl]-2,3-dihydroimidazo[2,1-a]isoquinoline
CID 14676800
2-(4-bromophenyl)-6-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 126077911
8-bromo-5-chloro-7-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine
CID 156697428
3-(2,4-dichlorophenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide
CID 52997837
5-chloro-N-(5-chloro-2-pyridinyl)-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide
CID 10162145

Frequently Asked Questions

What is the IUPAC name of 9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline?
The IUPAC name of 9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline (CID 132516663) is 9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline.
What is the SMILES notation for 9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline?
The canonical SMILES for 9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline is Clc1ccc(C2=Nc3c(I)cc(Br)cc3C3=NCCN23)cc1.
What is the InChIKey of 9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline?
The InChIKey is ZOALOPKQTSMHIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10BrClIN3/c17-10-7-12-14(13(19)8-10)21-15(22-6-5-20-16(12)22)9-1-3-11(18)4-2-9/h1-4,7-8H,5-6H2.
What are the key properties of 9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline?
9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline has a molecular weight of 486.54 g/mol, XLogP of 4.86, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-bromo-5-(4-chlorophenyl)-7-iodo-2,3-dihydroimidazo[1,2-c]quinazoline is sourced from PubChem (CID 132516663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).