4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine

C32H24N2O — CID 90274181

IUPAC4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine
SMILESC1=C(c2ccccc2)NC(c2ccc3ccccc3c2)NC1c1cccc2oc3ccccc3c12
InChIInChI=1S/C32H24N2O/c1-2-10-22(11-3-1)27-20-28(25-14-8-16-30-31(25)26-13-6-7-15-29(26)35-30)34-32(33-27)24-18-17-21-9-4-5-12-23(21)19-24/h1-20,28,32-34H
InChIKeyAXQFKZHAZYBPTE-UHFFFAOYSA-N
MW452.56 g/mol
LogP7.71
Rot. Bonds3

About 4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine

4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine (PubChem CID 90274181) has the molecular formula C32H24N2O and a molecular weight of 452.56 g/mol. Its IUPAC name is 4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine.

Molecular Properties

Compound Name4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine
PubChem CID90274181
Molecular FormulaC32H24N2O
Molecular Weight452.56 g/mol
Exact Mass452.19
IUPAC Name4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine
SMILESC1=C(c2ccccc2)NC(c2ccc3ccccc3c2)NC1c1cccc2oc3ccccc3c12
InChIInChI=1S/C32H24N2O/c1-2-10-22(11-3-1)27-20-28(25-14-8-16-30-31(25)26-13-6-7-15-29(26)35-30)34-32(33-27)24-18-17-21-9-4-5-12-23(21)19-24/h1-20,28,32-34H
InChIKeyAXQFKZHAZYBPTE-UHFFFAOYSA-N
XLogP7.71
TPSA37.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.56
LogP ≤ 57.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine 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

6-(4-benzo[a]anthracen-4-ylphenyl)-4-dibenzofuran-2-yl-2-phenyl-1,2,3,4-tetrahydropyrimidine
CID 167249702
2,6-diphenyl-4-[9-(4-phenylnaphthalen-1-yl)naphtho[1,2-b][1]benzofuran-7-yl]-1,2,3,4-tetrahydropyrimidine
CID 156553548
2-(3-naphthalen-2-yldibenzofuran-1-yl)-4-phenyl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazinane
CID 167029965
2-[2-(4-naphthalen-1-yl-6-phenyl-1,2,3,4-tetrahydropyrimidin-2-yl)naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazinane
CID 129099180
2-[1-[4-(2,6-diphenyl-1,2,3,4-tetrahydropyrimidin-4-yl)phenyl]naphthalen-2-yl]-4,6-diphenyl-1,3,5-triazinane
CID 129099634
2-[4-[4-[4-[4-(2,4-diphenyl-1,2,3,4-tetrahydropyrimidin-6-yl)phenyl]naphthalen-1-yl]naphthalen-1-yl]phenyl]-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine
CID 129228010
1-methyl-9-(4-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidin-2-yl)-2-phenyl-2H-naphtho[1,2-e][1,3]benzoxazole
CID 126614478
9-[4-(2-dibenzofuran-2-yl-4-phenyl-1,2,3,4-tetrahydropyrimidin-6-yl)phenyl]-1,2,4a,9a-tetrahydrocarbazole
CID 163902590
4-chrysen-2-yl-2-phenyl-6-[4-(7-phenylbenzo[a]anthracen-12-yl)phenyl]-1,2,3,4-tetrahydropyrimidine
CID 167250407
10-(4,6-diphenyl-1,2,3,4-tetrahydropyrimidin-2-yl)-2-phenyl-2,3-dihydronaphtho[2,1-g][1,3]benzoxazole
CID 126614349
9-(4,6-dinaphthalen-2-yl-1,2,3,4-tetrahydropyrimidin-2-yl)-2-phenyl-1,2-dihydronaphtho[1,2-e][1,3]benzothiazole
CID 126614289
2-[1-(4-naphthalen-1-yl-6-phenyl-1,2,3,4-tetrahydropyrimidin-2-yl)naphthalen-2-yl]-4,6-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazine
CID 129099479

Frequently Asked Questions

What is the IUPAC name of 4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine?
The IUPAC name of 4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine (CID 90274181) is 4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine.
What is the SMILES notation for 4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine?
The canonical SMILES for 4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine is C1=C(c2ccccc2)NC(c2ccc3ccccc3c2)NC1c1cccc2oc3ccccc3c12.
What is the InChIKey of 4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine?
The InChIKey is AXQFKZHAZYBPTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H24N2O/c1-2-10-22(11-3-1)27-20-28(25-14-8-16-30-31(25)26-13-6-7-15-29(26)35-30)34-32(33-27)24-18-17-21-9-4-5-12-23(21)19-24/h1-20,28,32-34H.
What are the key properties of 4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine?
4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine has a molecular weight of 452.56 g/mol, XLogP of 7.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dibenzofuran-1-yl-2-naphthalen-2-yl-6-phenyl-1,2,3,4-tetrahydropyrimidine is sourced from PubChem (CID 90274181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).