5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole

C43H26N4O — CID 163570321

IUPAC5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole
SMILESc1ccc2c(-c3ccc(-c4ccc(-c5ncnc(-n6c7ccccc7c7c8oc9ccccc9c8ccc76)n5)cc4)cc3)cccc2c1
InChIInChI=1S/C43H26N4O/c1-2-10-32-29(8-1)9-7-13-33(32)30-20-16-27(17-21-30)28-18-22-31(23-19-28)42-44-26-45-43(46-42)47-37-14-5-3-12-36(37)40-38(47)25-24-35-34-11-4-6-15-39(34)48-41(35)40/h1-26H
InChIKeyFYUGAPPGVFKWMS-UHFFFAOYSA-N
MW614.71 g/mol
LogP11.02
Rot. Bonds4

About 5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole

5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole (PubChem CID 163570321) has the molecular formula C43H26N4O and a molecular weight of 614.71 g/mol. Its IUPAC name is 5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole.

Molecular Properties

Compound Name5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole
PubChem CID163570321
Molecular FormulaC43H26N4O
Molecular Weight614.71 g/mol
Exact Mass614.21
IUPAC Name5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole
SMILESc1ccc2c(-c3ccc(-c4ccc(-c5ncnc(-n6c7ccccc7c7c8oc9ccccc9c8ccc76)n5)cc4)cc3)cccc2c1
InChIInChI=1S/C43H26N4O/c1-2-10-32-29(8-1)9-7-13-33(32)30-20-16-27(17-21-30)28-18-22-31(23-19-28)42-44-26-45-43(46-42)47-37-14-5-3-12-36(37)40-38(47)25-24-35-34-11-4-6-15-39(34)48-41(35)40/h1-26H
InChIKeyFYUGAPPGVFKWMS-UHFFFAOYSA-N
XLogP11.02
TPSA56.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500614.71
LogP ≤ 511.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[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

5-[4-[2-(4-phenylphenyl)phenyl]pyrimidin-2-yl]-[1]benzofuro[3,2-c]carbazole
CID 163673833
7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[c]carbazole
CID 166915499
2-(4-dibenzofuran-4-ylphenyl)-7-quinazolin-2-ylbenzo[c]carbazole
CID 131979722
14-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 176837448
5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole
CID 90225205
9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 166511989
4-dibenzofuran-4-yl-9-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole
CID 146491359
9-(4-dibenzofuran-4-ylphenyl)-14-(1,3,5-triazin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 118502038
24-[4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-4,15-dioxa-24-azaheptacyclo[14.11.0.02,14.03,11.05,10.017,25.018,23]heptacosa-1(16),2(14),3(11),5,7,9,12,17(25),18,20,22,26-dodecaene
CID 146281110
24-[4,6-bis(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene
CID 154593181
9-dibenzofuran-4-yl-14-(4-naphthalen-1-ylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 167029631
5-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole
CID 176837415

Frequently Asked Questions

What is the IUPAC name of 5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole?
The IUPAC name of 5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole (CID 163570321) is 5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole.
What is the SMILES notation for 5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole?
The canonical SMILES for 5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole is c1ccc2c(-c3ccc(-c4ccc(-c5ncnc(-n6c7ccccc7c7c8oc9ccccc9c8ccc76)n5)cc4)cc3)cccc2c1.
What is the InChIKey of 5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole?
The InChIKey is FYUGAPPGVFKWMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H26N4O/c1-2-10-32-29(8-1)9-7-13-33(32)30-20-16-27(17-21-30)28-18-22-31(23-19-28)42-44-26-45-43(46-42)47-37-14-5-3-12-36(37)40-38(47)25-24-35-34-11-4-6-15-39(34)48-41(35)40/h1-26H.
What are the key properties of 5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole?
5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole has a molecular weight of 614.71 g/mol, XLogP of 11.02, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-c]carbazole is sourced from PubChem (CID 163570321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).