9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole

C46H30N4 — CID 146335978

IUPAC9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc5c(c4)Cc4ccc(-n6c7ccccc7c7ccccc76)cc4-5)cc3)n2)cc1
InChIInChI=1S/C46H30N4/c1-3-11-31(12-4-1)44-47-45(32-13-5-2-6-14-32)49-46(48-44)33-21-19-30(20-22-33)34-24-26-38-36(27-34)28-35-23-25-37(29-41(35)38)50-42-17-9-7-15-39(42)40-16-8-10-18-43(40)50/h1-27,29H,28H2
InChIKeyCVMYTWMHGFARIH-UHFFFAOYSA-N
MW638.77 g/mol
LogP11.21
Rot. Bonds5

About 9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole

9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole (PubChem CID 146335978) has the molecular formula C46H30N4 and a molecular weight of 638.77 g/mol. Its IUPAC name is 9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole.

Molecular Properties

Compound Name9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole
PubChem CID146335978
Molecular FormulaC46H30N4
Molecular Weight638.77 g/mol
Exact Mass638.25
IUPAC Name9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc5c(c4)Cc4ccc(-n6c7ccccc7c7ccccc76)cc4-5)cc3)n2)cc1
InChIInChI=1S/C46H30N4/c1-3-11-31(12-4-1)44-47-45(32-13-5-2-6-14-32)49-46(48-44)33-21-19-30(20-22-33)34-24-26-38-36(27-34)28-35-23-25-37(29-41(35)38)50-42-17-9-7-15-39(42)40-16-8-10-18-43(40)50/h1-27,29H,28H2
InChIKeyCVMYTWMHGFARIH-UHFFFAOYSA-N
XLogP11.21
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500638.77
LogP ≤ 511.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-carbazol-9-yl-9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9H-fluoren-3-yl]carbazole
CID 159941537
11-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)-9H-fluoren-2-yl]-5-phenylindolo[3,2-b]carbazole
CID 170280570
9-[8-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5,12-dihydrotetracen-2-yl]carbazole
CID 139335327
9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)-6,11-dihydrotetracen-2-yl]carbazole
CID 139329534
9-(6-carbazol-9-yl-9H-fluoren-3-yl)carbazole
CID 59464809
9-[7-carbazol-9-yl-10-(4,6-diphenyl-1,3,5-triazin-2-yl)tetraphenylen-2-yl]carbazole
CID 119078686
9-[4-[4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]carbazole
CID 122425259
9-[4-[4-[4-[4-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazole
CID 59779621
9-[3-(2,6-diphenyl-4-pyridinyl)-5,7-dihydrobenzo[d][2]benzothiepin-10-yl]carbazole
CID 121441466
3-carbazol-9-yl-9-[9-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]carbazole
CID 90211361
9-[3-[3-[4-[4-[4-[3-(3-carbazol-9-ylphenyl)phenyl]phenyl]-6-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazole
CID 177124510
2-carbazol-9-yl-9-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 164807814

Frequently Asked Questions

What is the IUPAC name of 9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole?
The IUPAC name of 9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole (CID 146335978) is 9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole.
What is the SMILES notation for 9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole?
The canonical SMILES for 9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole is c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc5c(c4)Cc4ccc(-n6c7ccccc7c7ccccc76)cc4-5)cc3)n2)cc1.
What is the InChIKey of 9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole?
The InChIKey is CVMYTWMHGFARIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H30N4/c1-3-11-31(12-4-1)44-47-45(32-13-5-2-6-14-32)49-46(48-44)33-21-19-30(20-22-33)34-24-26-38-36(27-34)28-35-23-25-37(29-41(35)38)50-42-17-9-7-15-39(42)40-16-8-10-18-43(40)50/h1-27,29H,28H2.
What are the key properties of 9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole?
9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole has a molecular weight of 638.77 g/mol, XLogP of 11.21, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]carbazole is sourced from PubChem (CID 146335978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).