2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine

C32H24N2 — CID 174321754

IUPAC2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine
SMILESC1=C(c2ccccc2)NC(c2ccccc2)N=C1c1cc(-c2ccccc2)c2ccccc2c1
InChIInChI=1S/C32H24N2/c1-4-12-23(13-5-1)29-21-27(20-26-18-10-11-19-28(26)29)31-22-30(24-14-6-2-7-15-24)33-32(34-31)25-16-8-3-9-17-25/h1-22,32-33H
InChIKeyIBTGOWDAZXCPBZ-UHFFFAOYSA-N
MW436.56 g/mol
LogP7.64
Rot. Bonds4

About 2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine

2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine (PubChem CID 174321754) has the molecular formula C32H24N2 and a molecular weight of 436.56 g/mol. Its IUPAC name is 2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine.

Molecular Properties

Compound Name2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine
PubChem CID174321754
Molecular FormulaC32H24N2
Molecular Weight436.56 g/mol
Exact Mass436.19
IUPAC Name2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine
SMILESC1=C(c2ccccc2)NC(c2ccccc2)N=C1c1cc(-c2ccccc2)c2ccccc2c1
InChIInChI=1S/C32H24N2/c1-4-12-23(13-5-1)29-21-27(20-26-18-10-11-19-28(26)29)31-22-30(24-14-6-2-7-15-24)33-32(34-31)25-16-8-3-9-17-25/h1-22,32-33H
InChIKeyIBTGOWDAZXCPBZ-UHFFFAOYSA-N
XLogP7.64
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500436.56
LogP ≤ 57.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[7-[4-(2,4-diphenyl-1,2-dihydropyrimidin-6-yl)phenyl]naphthalen-1-yl]naphthalene-1-carbonitrile
CID 142487970
4-[4-[4-(2,4-diphenyl-1,2-dihydropyrimidin-6-yl)phenyl]naphthalen-1-yl]-2,6-diphenyl-1,2-dihydro-1,3,5-triazine
CID 148755581
4,6-diphenyl-2-[3-[3-(3-triphenylen-2-ylphenyl)phenyl]phenyl]-1,2-dihydropyrimidine
CID 174243578
7-[4-(2,6-diphenyl-1,2-dihydropyrimidin-4-yl)phenyl]-3-(6-naphthalen-1-ylnaphthalen-2-yl)benzo[c]carbazole
CID 137214923
4-(3-dibenzofuran-1-ylphenyl)-2,6-diphenyl-1,2-dihydropyrimidine
CID 130374602
9-[4-(2,4-diphenyl-1,2-dihydropyrimidin-6-yl)phenyl]carbazole
CID 155382380
4,6-diphenyl-2-[4-(4-phenylnaphthalen-1-yl)naphtho[2,3-b][1]benzofuran-2-yl]-1,2-dihydropyrimidine
CID 156553980
9-[4-[4-(2,4-diphenyl-1,2-dihydropyrimidin-6-yl)phenyl]phenyl]carbazole
CID 144680701
6-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-4-naphthalen-1-yl-2-phenyl-1,2-dihydropyrimidine
CID 137302868
4-(3-naphthalen-2-ylphenyl)-2-phenyl-6-(3-pyridin-3-ylphenyl)-1,2-dihydropyrimidine
CID 145302608
2-[4-[1-[2-[4-(4,6-diphenyl-1,2-dihydropyrimidin-2-yl)phenyl]phenyl]naphthalen-2-yl]phenyl]-4,6-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazine
CID 170277804
6-carbazol-9-yl-9-[4-(2,4-diphenyl-1,2-dihydropyrimidin-6-yl)-2,6-diphenylphenyl]-2-phenylcarbazole
CID 164968420

Frequently Asked Questions

What is the IUPAC name of 2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine?
The IUPAC name of 2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine (CID 174321754) is 2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine.
What is the SMILES notation for 2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine?
The canonical SMILES for 2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine is C1=C(c2ccccc2)NC(c2ccccc2)N=C1c1cc(-c2ccccc2)c2ccccc2c1.
What is the InChIKey of 2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine?
The InChIKey is IBTGOWDAZXCPBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H24N2/c1-4-12-23(13-5-1)29-21-27(20-26-18-10-11-19-28(26)29)31-22-30(24-14-6-2-7-15-24)33-32(34-31)25-16-8-3-9-17-25/h1-22,32-33H.
What are the key properties of 2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine?
2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine has a molecular weight of 436.56 g/mol, XLogP of 7.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diphenyl-4-(4-phenylnaphthalen-2-yl)-1,2-dihydropyrimidine is sourced from PubChem (CID 174321754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).