6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine

C21H11FN6O — CID 164824366

IUPAC6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine
SMILESFc1ccc(-c2nc3nnnnc3n2-c2ccccc2)c2oc3ccccc3c12
InChIInChI=1S/C21H11FN6O/c22-15-11-10-14(18-17(15)13-8-4-5-9-16(13)29-18)20-23-19-21(25-27-26-24-19)28(20)12-6-2-1-3-7-12/h1-11H
InChIKeyJWRRXXSZEZYVAD-UHFFFAOYSA-N
MW382.36 g/mol
LogP4.31
Rot. Bonds2

About 6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine

6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine (PubChem CID 164824366) has the molecular formula C21H11FN6O and a molecular weight of 382.36 g/mol. Its IUPAC name is 6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine.

Molecular Properties

Compound Name6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine
PubChem CID164824366
Molecular FormulaC21H11FN6O
Molecular Weight382.36 g/mol
Exact Mass382.10
IUPAC Name6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine
SMILESFc1ccc(-c2nc3nnnnc3n2-c2ccccc2)c2oc3ccccc3c12
InChIInChI=1S/C21H11FN6O/c22-15-11-10-14(18-17(15)13-8-4-5-9-16(13)29-18)20-23-19-21(25-27-26-24-19)28(20)12-6-2-1-3-7-12/h1-11H
InChIKeyJWRRXXSZEZYVAD-UHFFFAOYSA-N
XLogP4.31
TPSA82.52 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.36
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine 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

2-(1-fluorodibenzofuran-4-yl)-6-methyl-1-phenylimidazo[4,5-c]pyridine
CID 164825457
2-(1-fluorodibenzofuran-4-yl)-4-methyl-1-phenylimidazo[4,5-c]quinoline
CID 164826690
6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine
CID 164825734
2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole
CID 156659191
2-(1-methyldibenzofuran-4-yl)-1-phenylimidazo[4,5-b]pyridine
CID 164825150
6-tert-butyl-2-(1-methyldibenzofuran-4-yl)-1-phenylimidazo[4,5-b]pyridine
CID 164826244
7-methyl-2-(1-methyldibenzofuran-4-yl)-1-phenylimidazo[4,5-c]pyridine
CID 164826577
2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline
CID 164826444
3-phenyl-2-[1-(trideuteriomethyl)dibenzofuran-4-yl]imidazo[4,5-c]pyridine
CID 156658601
12-(4-chlorophenyl)-9-phenyl-14-oxa-9,11-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1,3,5,7,10,12,15,17,19-nonaene
CID 170065691
6-tert-butyl-2-dibenzofuran-4-yl-1-phenylimidazo[4,5-b]pyridine
CID 164826557
6-[7-(2-deuteriopropan-2-yl)dibenzofuran-4-yl]-7-phenylimidazo[4,5-e][1,2,4]triazine
CID 164825846

Frequently Asked Questions

What is the IUPAC name of 6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine?
The IUPAC name of 6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine (CID 164824366) is 6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine.
What is the SMILES notation for 6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine?
The canonical SMILES for 6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine is Fc1ccc(-c2nc3nnnnc3n2-c2ccccc2)c2oc3ccccc3c12.
What is the InChIKey of 6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine?
The InChIKey is JWRRXXSZEZYVAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H11FN6O/c22-15-11-10-14(18-17(15)13-8-4-5-9-16(13)29-18)20-23-19-21(25-27-26-24-19)28(20)12-6-2-1-3-7-12/h1-11H.
What are the key properties of 6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine?
6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine has a molecular weight of 382.36 g/mol, XLogP of 4.31, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine is sourced from PubChem (CID 164824366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).