4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine

C26H24N4O — CID 69013924

IUPAC4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine
SMILESNc1nc(NC2CCCCC2)c2cc(-c3cccc4c3oc3ccccc34)ccc2n1
InChIInChI=1S/C26H24N4O/c27-26-29-22-14-13-16(15-21(22)25(30-26)28-17-7-2-1-3-8-17)18-10-6-11-20-19-9-4-5-12-23(19)31-24(18)20/h4-6,9-15,17H,1-3,7-8H2,(H3,27,28,29,30)
InChIKeyLBJHNYKZBBJIKB-UHFFFAOYSA-N
MW408.51 g/mol
LogP6.52
Rot. Bonds3

About 4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine

4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine (PubChem CID 69013924) has the molecular formula C26H24N4O and a molecular weight of 408.51 g/mol. Its IUPAC name is 4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine.

Molecular Properties

Compound Name4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine
PubChem CID69013924
Molecular FormulaC26H24N4O
Molecular Weight408.51 g/mol
Exact Mass408.20
IUPAC Name4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine
SMILESNc1nc(NC2CCCCC2)c2cc(-c3cccc4c3oc3ccccc34)ccc2n1
InChIInChI=1S/C26H24N4O/c27-26-29-22-14-13-16(15-21(22)25(30-26)28-17-7-2-1-3-8-17)18-10-6-11-20-19-9-4-5-12-23(19)31-24(18)20/h4-6,9-15,17H,1-3,7-8H2,(H3,27,28,29,30)
InChIKeyLBJHNYKZBBJIKB-UHFFFAOYSA-N
XLogP6.52
TPSA76.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.51
LogP ≤ 56.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-N-cyclohexyl-6-(4-phenylphenyl)quinazoline-2,4-diamine
CID 69014350
4-N-cyclohexyl-6-(2-phenylmethoxyphenyl)quinazoline-2,4-diamine
CID 69013354
4-N-cyclooctylquinazoline-2,4-diamine
CID 80786546
4-N-cyclohexyl-6-[3-(dimethylamino)phenyl]quinazoline-2,4-diamine
CID 69015335
2-[2-[2-amino-4-(cyclohexylamino)quinazolin-6-yl]anilino]butanedial
CID 87685599
6-(6-bromo-5-methyl-3-pyridinyl)-4-N-cyclohexylquinazoline-2,4-diamine
CID 87656658
4-N-cyclohexyl-6-[4-(oxan-2-yloxy)phenyl]quinazoline-2,4-diamine
CID 69014715
2-chloro-6-dibenzofuran-4-yl-4-phenylquinazoline
CID 139327756
4-(9,10-diphenylanthracen-2-yl)dibenzofuran
CID 58991794
7,19-di(dibenzofuran-4-yl)-10,16-dioxahexacyclo[11.11.0.03,11.04,9.015,23.017,22]tetracosa-1,3(11),4(9),5,7,12,14,17(22),18,20,23-undecaene
CID 149458315
2-(4-dibenzofuran-4-ylphenyl)-4-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenyl-1,3,5-triazine
CID 165151324
3-dibenzofuran-4-yl-6-(4-phenylphenyl)-9H-carbazole
CID 66800210

Frequently Asked Questions

What is the IUPAC name of 4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine?
The IUPAC name of 4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine (CID 69013924) is 4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine.
What is the SMILES notation for 4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine?
The canonical SMILES for 4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine is Nc1nc(NC2CCCCC2)c2cc(-c3cccc4c3oc3ccccc34)ccc2n1.
What is the InChIKey of 4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine?
The InChIKey is LBJHNYKZBBJIKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N4O/c27-26-29-22-14-13-16(15-21(22)25(30-26)28-17-7-2-1-3-8-17)18-10-6-11-20-19-9-4-5-12-23(19)31-24(18)20/h4-6,9-15,17H,1-3,7-8H2,(H3,27,28,29,30).
What are the key properties of 4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine?
4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine has a molecular weight of 408.51 g/mol, XLogP of 6.52, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclohexyl-6-dibenzofuran-4-ylquinazoline-2,4-diamine is sourced from PubChem (CID 69013924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).