6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole

C40H25N5O — CID 118229485

IUPAC6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole
SMILESc1ccc2c(c1)c1c3occc3ccc1n2-c1ccc(-c2nc(-c3ccncc3)cc(-c3ccc(-c4ccncc4)cc3)n2)cc1
InChIInChI=1S/C40H25N5O/c1-2-4-36-33(3-1)38-37(14-11-30-19-24-46-39(30)38)45(36)32-12-9-31(10-13-32)40-43-34(25-35(44-40)29-17-22-42-23-18-29)28-7-5-26(6-8-28)27-15-20-41-21-16-27/h1-25H
InChIKeyJYIVPRYPHGCKKG-UHFFFAOYSA-N
MW591.67 g/mol
LogP9.78
Rot. Bonds5

About 6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole

6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole (PubChem CID 118229485) has the molecular formula C40H25N5O and a molecular weight of 591.67 g/mol. Its IUPAC name is 6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole.

Molecular Properties

Compound Name6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole
PubChem CID118229485
Molecular FormulaC40H25N5O
Molecular Weight591.67 g/mol
Exact Mass591.21
IUPAC Name6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole
SMILESc1ccc2c(c1)c1c3occc3ccc1n2-c1ccc(-c2nc(-c3ccncc3)cc(-c3ccc(-c4ccncc4)cc3)n2)cc1
InChIInChI=1S/C40H25N5O/c1-2-4-36-33(3-1)38-37(14-11-30-19-24-46-39(30)38)45(36)32-12-9-31(10-13-32)40-43-34(25-35(44-40)29-17-22-42-23-18-29)28-7-5-26(6-8-28)27-15-20-41-21-16-27/h1-25H
InChIKeyJYIVPRYPHGCKKG-UHFFFAOYSA-N
XLogP9.78
TPSA69.63 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500591.67
LogP ≤ 59.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole 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-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]furo[3,2-c]carbazole
CID 118229476
6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]furo[3,2-c]carbazole
CID 118229450
6-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole
CID 118229522
6-(2,6-diphenyl-4-pyridinyl)furo[3,2-c]carbazole
CID 123472648
6-[3-[6-pyridin-4-yl-4-(4-pyridin-4-ylphenyl)-2-pyridinyl]phenyl]furo[3,2-c]carbazole;6-[2-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-4-yl]furo[3,2-c]carbazole;6-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]furo[3,2-c]carbazole
CID 157354749
6-[4-(4,6-dipyridin-4-yl-2-pyridinyl)phenyl]-2-phenyl-[1,3]oxazolo[4,5-c]carbazole;6-[4-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2-phenyl-[1,3]oxazolo[4,5-c]carbazole;6-[4-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2-phenyl-[1,3]oxazolo[4,5-c]carbazole
CID 159825657
6-[4-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2-phenylthieno[3,2-c]carbazole
CID 118229475
6-(5-pyridin-4-yl-2-pyridinyl)furo[3,2-c]carbazole
CID 123596887
6-[3-[4-(1,2-dihydropyridin-4-yl)-6-pyridin-4-ylpyrimidin-2-yl]phenyl]furo[3,2-c]carbazole
CID 118227981
6-(3,5-diphenylphenyl)furo[3,2-c]carbazole;6-phenylfuro[3,2-c]carbazole;6-(3-phenylphenyl)furo[3,2-c]carbazole;6-(4-phenylphenyl)furo[3,2-c]carbazole
CID 159669938
6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2-phenyl-[1,3]oxazolo[4,5-c]carbazole
CID 123490836
7-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]benzo[c]carbazole
CID 121422958

Frequently Asked Questions

What is the IUPAC name of 6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole?
The IUPAC name of 6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole (CID 118229485) is 6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole.
What is the SMILES notation for 6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole?
The canonical SMILES for 6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole is c1ccc2c(c1)c1c3occc3ccc1n2-c1ccc(-c2nc(-c3ccncc3)cc(-c3ccc(-c4ccncc4)cc3)n2)cc1.
What is the InChIKey of 6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole?
The InChIKey is JYIVPRYPHGCKKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H25N5O/c1-2-4-36-33(3-1)38-37(14-11-30-19-24-46-39(30)38)45(36)32-12-9-31(10-13-32)40-43-34(25-35(44-40)29-17-22-42-23-18-29)28-7-5-26(6-8-28)27-15-20-41-21-16-27/h1-25H.
What are the key properties of 6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole?
6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole has a molecular weight of 591.67 g/mol, XLogP of 9.78, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[4-pyridin-4-yl-6-(4-pyridin-4-ylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole is sourced from PubChem (CID 118229485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).