4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine

C30H21N3O — CID 164824756

IUPAC4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine
SMILESCc1cc2nc(-c3cccc4c3oc3c5ccccc5ccc43)n(-c3ccccc3)c2c(C)n1
InChIInChI=1S/C30H21N3O/c1-18-17-26-27(19(2)31-18)33(21-10-4-3-5-11-21)30(32-26)25-14-8-13-23-24-16-15-20-9-6-7-12-22(20)28(24)34-29(23)25/h3-17H,1-2H3
InChIKeyKVLTYLYUJJVBSB-UHFFFAOYSA-N
MW439.52 g/mol
LogP7.76
Rot. Bonds2

About 4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine

4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine (PubChem CID 164824756) has the molecular formula C30H21N3O and a molecular weight of 439.52 g/mol. Its IUPAC name is 4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine
PubChem CID164824756
Molecular FormulaC30H21N3O
Molecular Weight439.52 g/mol
Exact Mass439.17
IUPAC Name4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine
SMILESCc1cc2nc(-c3cccc4c3oc3c5ccccc5ccc43)n(-c3ccccc3)c2c(C)n1
InChIInChI=1S/C30H21N3O/c1-18-17-26-27(19(2)31-18)33(21-10-4-3-5-11-21)30(32-26)25-14-8-13-23-24-16-15-20-9-6-7-12-22(20)28(24)34-29(23)25/h3-17H,1-2H3
InChIKeyKVLTYLYUJJVBSB-UHFFFAOYSA-N
XLogP7.76
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500439.52
LogP ≤ 57.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine with MolForge

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Related Compounds

[6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane
CID 164824338
2-naphtho[1,2-b][1]benzofuran-10-yl-1-phenylimidazo[4,5-c]pyridine
CID 164824950
8-[3-(4-tert-butyl-2,6-diphenylphenyl)-4,6-dimethylimidazo[4,5-c]pyridin-2-yl]-2-phenyl-[1]benzofuro[2,3-b]pyridine
CID 156667463
4,6-dimethyl-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)-3-phenylimidazo[4,5-c]pyridine;iridium;trimethyl-(6-phenyl-3-pyridinyl)silane
CID 164824755
2-naphtho[1,2-b][1]benzofuran-10-yl-1-(2-phenylphenyl)benzo[e]benzimidazole
CID 156660260
2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]isoquinoline
CID 164825395
7-tert-butyl-2-(3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4(9),5,7,11,14,16,18,20-decaen-5-yl)-1-phenylimidazo[4,5-c]pyridine
CID 164825662
2-(7-fluorodibenzofuran-4-yl)-4-methyl-1-phenylimidazo[4,5-c]quinoline
CID 164826973
trimethyl-[6-(7-methyl-1-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]silane
CID 164826478
trimethyl-[4-(2-naphtho[1,2-b][1]benzofuran-10-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]silane
CID 176583988
2-(7-fluorodibenzofuran-4-yl)-6-methyl-1-phenylimidazo[4,5-c]pyridine
CID 164827019
3-(4-tert-butyl-2,6-diphenylphenyl)-2-[7-(1-cyclopentylethyl)dibenzofuran-4-yl]-4,6-dimethylimidazo[4,5-c]pyridine
CID 156669038

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine?
The IUPAC name of 4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine (CID 164824756) is 4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine.
What is the SMILES notation for 4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine?
The canonical SMILES for 4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine is Cc1cc2nc(-c3cccc4c3oc3c5ccccc5ccc43)n(-c3ccccc3)c2c(C)n1.
What is the InChIKey of 4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine?
The InChIKey is KVLTYLYUJJVBSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H21N3O/c1-18-17-26-27(19(2)31-18)33(21-10-4-3-5-11-21)30(32-26)25-14-8-13-23-24-16-15-20-9-6-7-12-22(20)28(24)34-29(23)25/h3-17H,1-2H3.
What are the key properties of 4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine?
4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine has a molecular weight of 439.52 g/mol, XLogP of 7.76, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2-naphtho[1,2-b][1]benzofuran-10-yl-3-phenylimidazo[4,5-c]pyridine is sourced from PubChem (CID 164824756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).