3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole

C102H66N6 — CID 164983675

IUPAC3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6ccccc56)ccc43)c2)cc1.c1ccc(-c2cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6ccccc56)ccc43)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/2C51H33N3/c1-3-15-35(16-4-1)45-32-39(33-46(52-45)36-17-5-2-6-18-36)53-48-23-11-9-21-41(48)43-30-37(26-28-50(43)53)38-27-29-51-44(31-38)42-22-10-12-24-49(42)54(51)47-25-13-19-34-14-7-8-20-40(34)47;1-3-14-34(15-4-1)39-32-45(36-17-5-2-6-18-36)52-51(33-39)54-48-24-12-10-22-42(48)44-31-38(27-29-50(44)54)37-26-28-49-43(30-37)41-21-9-11-23-47(41)53(49)46-25-13-19-35-16-7-8-20-40(35)46/h2*1-33H
InChIKeyFVSBSLZGDSLKGA-UHFFFAOYSA-N
MW1375.69 g/mol
LogP26.86
Rot. Bonds10

About 3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole

3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole (PubChem CID 164983675) has the molecular formula C102H66N6 and a molecular weight of 1375.69 g/mol. Its IUPAC name is 3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole.

Molecular Properties

Compound Name3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole
PubChem CID164983675
Molecular FormulaC102H66N6
Molecular Weight1375.69 g/mol
Exact Mass1374.53
IUPAC Name3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6ccccc56)ccc43)c2)cc1.c1ccc(-c2cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6ccccc56)ccc43)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/2C51H33N3/c1-3-15-35(16-4-1)45-32-39(33-46(52-45)36-17-5-2-6-18-36)53-48-23-11-9-21-41(48)43-30-37(26-28-50(43)53)38-27-29-51-44(31-38)42-22-10-12-24-49(42)54(51)47-25-13-19-34-14-7-8-20-40(34)47;1-3-14-34(15-4-1)39-32-45(36-17-5-2-6-18-36)52-51(33-39)54-48-24-12-10-22-42(48)44-31-38(27-29-50(44)54)37-26-28-49-43(30-37)41-21-9-11-23-47(41)53(49)46-25-13-19-35-16-7-8-20-40(35)46/h2*1-33H
InChIKeyFVSBSLZGDSLKGA-UHFFFAOYSA-N
XLogP26.86
TPSA45.50 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms108
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001375.69
LogP ≤ 526.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole?
The IUPAC name of 3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole (CID 164983675) is 3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole.
What is the SMILES notation for 3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole?
The canonical SMILES for 3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole is c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6ccccc56)ccc43)c2)cc1.c1ccc(-c2cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6ccccc56)ccc43)cc(-c3ccccc3)n2)cc1.
What is the InChIKey of 3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole?
The InChIKey is FVSBSLZGDSLKGA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C51H33N3/c1-3-15-35(16-4-1)45-32-39(33-46(52-45)36-17-5-2-6-18-36)53-48-23-11-9-21-41(48)43-30-37(26-28-50(43)53)38-27-29-51-44(31-38)42-22-10-12-24-49(42)54(51)47-25-13-19-34-14-7-8-20-40(34)47;1-3-14-34(15-4-1)39-32-45(36-17-5-2-6-18-36)52-51(33-39)54-48-24-12-10-22-42(48)44-31-38(27-29-50(44)54)37-26-28-49-43(30-37)41-21-9-11-23-47(41)53(49)46-25-13-19-35-16-7-8-20-40(35)46/h2*1-33H.
What are the key properties of 3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole?
3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole has a molecular weight of 1375.69 g/mol, XLogP of 26.86, 10 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole is sourced from PubChem (CID 164983675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).