9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene

C140H92N4O2 — CID 159134431

IUPAC9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene
SMILESCOc1ccc2cc(-c3cccc4c(-c5ccc(OC)c6ccccc56)cccc34)ccc2c1.c1cc(-c2ccc(-n3c4ccccc4c4ccccc43)c3ccccc23)c2cccc(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)c2c1.c1cc(-c2ccc3cc(-n4c5ccccc5c5ccccc54)ccc3c2)c2cccc(-c3ccc4cc(-n5c6ccccc6c6ccccc65)ccc4c3)c2c1
InChIInChI=1S/2C54H34N2.C32H24O2/c1-5-19-51-47(11-1)48-12-2-6-20-52(48)55(51)41-29-27-35-31-39(25-23-37(35)33-41)43-15-9-18-46-44(16-10-17-45(43)46)40-26-24-38-34-42(30-28-36(38)32-40)56-53-21-7-3-13-49(53)50-14-4-8-22-54(50)56;1-3-17-43-39(15-1)41(31-33-53(43)55-49-27-9-5-19-45(49)46-20-6-10-28-50(46)55)37-25-13-24-36-35(37)23-14-26-38(36)42-32-34-54(44-18-4-2-16-40(42)44)56-51-29-11-7-21-47(51)48-22-8-12-30-52(48)56;1-33-24-16-15-21-19-23(14-13-22(21)20-24)25-9-5-11-27-26(25)10-6-12-28(27)30-17-18-32(34-2)31-8-4-3-7-29(30)31/h2*1-34H;3-20H,1-2H3
InChIKeyKHHOZVCRXQYYHL-UHFFFAOYSA-N
MW1862.30 g/mol
LogP37.85
Rot. Bonds12

About 9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene

9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene (PubChem CID 159134431) has the molecular formula C140H92N4O2 and a molecular weight of 1862.30 g/mol. Its IUPAC name is 9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene.

Molecular Properties

Compound Name9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene
PubChem CID159134431
Molecular FormulaC140H92N4O2
Molecular Weight1862.30 g/mol
Exact Mass1860.72
IUPAC Name9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene
SMILESCOc1ccc2cc(-c3cccc4c(-c5ccc(OC)c6ccccc56)cccc34)ccc2c1.c1cc(-c2ccc(-n3c4ccccc4c4ccccc43)c3ccccc23)c2cccc(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)c2c1.c1cc(-c2ccc3cc(-n4c5ccccc5c5ccccc54)ccc3c2)c2cccc(-c3ccc4cc(-n5c6ccccc6c6ccccc65)ccc4c3)c2c1
InChIInChI=1S/2C54H34N2.C32H24O2/c1-5-19-51-47(11-1)48-12-2-6-20-52(48)55(51)41-29-27-35-31-39(25-23-37(35)33-41)43-15-9-18-46-44(16-10-17-45(43)46)40-26-24-38-34-42(30-28-36(38)32-40)56-53-21-7-3-13-49(53)50-14-4-8-22-54(50)56;1-3-17-43-39(15-1)41(31-33-53(43)55-49-27-9-5-19-45(49)46-20-6-10-28-50(46)55)37-25-13-24-36-35(37)23-14-26-38(36)42-32-34-54(44-18-4-2-16-40(42)44)56-51-29-11-7-21-47(51)48-22-8-12-30-52(48)56;1-33-24-16-15-21-19-23(14-13-22(21)20-24)25-9-5-11-27-26(25)10-6-12-28(27)30-17-18-32(34-2)31-8-4-3-7-29(30)31/h2*1-34H;3-20H,1-2H3
InChIKeyKHHOZVCRXQYYHL-UHFFFAOYSA-N
XLogP37.85
TPSA38.18 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms146
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001862.30
LogP ≤ 537.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene?
The IUPAC name of 9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene (CID 159134431) is 9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene.
What is the SMILES notation for 9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene?
The canonical SMILES for 9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene is COc1ccc2cc(-c3cccc4c(-c5ccc(OC)c6ccccc56)cccc34)ccc2c1.c1cc(-c2ccc(-n3c4ccccc4c4ccccc43)c3ccccc23)c2cccc(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)c2c1.c1cc(-c2ccc3cc(-n4c5ccccc5c5ccccc54)ccc3c2)c2cccc(-c3ccc4cc(-n5c6ccccc6c6ccccc65)ccc4c3)c2c1.
What is the InChIKey of 9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene?
The InChIKey is KHHOZVCRXQYYHL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C54H34N2.C32H24O2/c1-5-19-51-47(11-1)48-12-2-6-20-52(48)55(51)41-29-27-35-31-39(25-23-37(35)33-41)43-15-9-18-46-44(16-10-17-45(43)46)40-26-24-38-34-42(30-28-36(38)32-40)56-53-21-7-3-13-49(53)50-14-4-8-22-54(50)56;1-3-17-43-39(15-1)41(31-33-53(43)55-49-27-9-5-19-45(49)46-20-6-10-28-50(46)55)37-25-13-24-36-35(37)23-14-26-38(36)42-32-34-54(44-18-4-2-16-40(42)44)56-51-29-11-7-21-47(51)48-22-8-12-30-52(48)56;1-33-24-16-15-21-19-23(14-13-22(21)20-24)25-9-5-11-27-26(25)10-6-12-28(27)30-17-18-32(34-2)31-8-4-3-7-29(30)31/h2*1-34H;3-20H,1-2H3.
What are the key properties of 9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene?
9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene has a molecular weight of 1862.30 g/mol, XLogP of 37.85, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene is sourced from PubChem (CID 159134431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).