5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene]

C179H117N15Si2 — CID 161485637

IUPAC5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene]
SMILESCc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)N(c4nc(-c6ccccc6)nc(-c6ccccc6)n4)c4ccccc4[Si]54c5ccccc5-c5ccccc54)ccc32)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)N(c5nc(-c7ccccc7)nc(-c7ccccc7)n5)c5ccccc5C65c6ccccc6-c6ccccc65)ccc43)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(N3c4ccccc4[Si]4(c5ccccc5-c5ccccc54)c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc43)n2)cc1
InChIInChI=1S/C64H41N5.C58H39N5Si.C57H37N5Si/c1-4-18-42(19-5-1)43-32-36-48(37-33-43)68-57-30-16-12-26-51(57)52-40-46(35-39-58(52)68)47-34-38-56-60(41-47)69(63-66-61(44-20-6-2-7-21-44)65-62(67-63)45-22-8-3-9-23-45)59-31-17-15-29-55(59)64(56)53-27-13-10-24-49(53)50-25-11-14-28-54(50)64;1-38-28-32-43(33-29-38)62-48-23-11-8-20-44(48)47-36-41(30-34-49(47)62)42-31-35-55-51(37-42)63(58-60-56(39-16-4-2-5-17-39)59-57(61-58)40-18-6-3-7-19-40)50-24-12-15-27-54(50)64(55)52-25-13-9-21-45(52)46-22-10-14-26-53(46)64;1-4-18-38(19-5-1)55-58-56(39-20-6-2-7-21-39)60-57(59-55)62-49-28-14-17-31-53(49)63(51-29-15-11-25-44(51)45-26-12-16-30-52(45)63)54-35-33-41(37-50(54)62)40-32-34-48-46(36-40)43-24-10-13-27-47(43)61(48)42-22-8-3-9-23-42/h1-41H;2-37H,1H3;1-37H
InChIKeyWEYATYVISHAJKQ-UHFFFAOYSA-N
MW2534.18 g/mol
LogP38.31
Rot. Bonds16

About 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene]

5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene] (PubChem CID 161485637) has the molecular formula C179H117N15Si2 and a molecular weight of 2534.18 g/mol. Its IUPAC name is 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene].

Molecular Properties

Compound Name5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene]
PubChem CID161485637
Molecular FormulaC179H117N15Si2
Molecular Weight2534.18 g/mol
Exact Mass2531.92
IUPAC Name5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene]
SMILESCc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)N(c4nc(-c6ccccc6)nc(-c6ccccc6)n4)c4ccccc4[Si]54c5ccccc5-c5ccccc54)ccc32)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)N(c5nc(-c7ccccc7)nc(-c7ccccc7)n5)c5ccccc5C65c6ccccc6-c6ccccc65)ccc43)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(N3c4ccccc4[Si]4(c5ccccc5-c5ccccc54)c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc43)n2)cc1
InChIInChI=1S/C64H41N5.C58H39N5Si.C57H37N5Si/c1-4-18-42(19-5-1)43-32-36-48(37-33-43)68-57-30-16-12-26-51(57)52-40-46(35-39-58(52)68)47-34-38-56-60(41-47)69(63-66-61(44-20-6-2-7-21-44)65-62(67-63)45-22-8-3-9-23-45)59-31-17-15-29-55(59)64(56)53-27-13-10-24-49(53)50-25-11-14-28-54(50)64;1-38-28-32-43(33-29-38)62-48-23-11-8-20-44(48)47-36-41(30-34-49(47)62)42-31-35-55-51(37-42)63(58-60-56(39-16-4-2-5-17-39)59-57(61-58)40-18-6-3-7-19-40)50-24-12-15-27-54(50)64(55)52-25-13-9-21-45(52)46-22-10-14-26-53(46)64;1-4-18-38(19-5-1)55-58-56(39-20-6-2-7-21-39)60-57(59-55)62-49-28-14-17-31-53(49)63(51-29-15-11-25-44(51)45-26-12-16-30-52(45)63)54-35-33-41(37-50(54)62)40-32-34-48-46(36-40)43-24-10-13-27-47(43)61(48)42-22-8-3-9-23-42/h1-41H;2-37H,1H3;1-37H
InChIKeyWEYATYVISHAJKQ-UHFFFAOYSA-N
XLogP38.31
TPSA140.52 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds16
Heavy Atoms196
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002534.18
LogP ≤ 538.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene] with MolForge

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Related Compounds

5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]
CID 123634048
5-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]
CID 123558227
10-(4,6-diphenylpyrimidin-2-yl)-2'-[9-(4-methylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene]
CID 118231877
10-(4,6-diphenylpyrimidin-2-yl)-2'-[9-(4-methylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene];10-(4,6-diphenylpyrimidin-2-yl)-2'-[9-(3-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene];10-(4,6-diphenylpyrimidin-2-yl)-2'-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene]
CID 159371492
10-phenyl-3'-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene]
CID 163947918
10'-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-(4-phenylphenyl)spiro[9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene-14,9'-acridine]
CID 118104005
10-(4,6-diphenyl-2-pyridinyl)-2'-[9-(4-methylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene];10-(4,6-diphenyl-2-pyridinyl)-2'-(9-phenylcarbazol-3-yl)spiro[acridine-9,9'-fluorene];10-(4,6-diphenyl-2-pyridinyl)-2'-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene]
CID 157249791
10-(4,6-diphenylpyrimidin-2-yl)-2'-[4-[9-(3-phenylphenyl)carbazol-3-yl]phenyl]spiro[acridine-9,9'-fluorene]
CID 118231882
10-phenyl-14-(5,5'-spirobi[benzo[b][1]benzosilole]-3-yl)spiro[10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,9'-fluorene]
CID 177278031
10-(4,6-diphenyl-1,3,5-triazin-2-yl)-21-phenylspiro[10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-14,9'-fluorene]
CID 66804868
3-[4-(9,9-dimethylfluoren-2-yl)-6-(3-phenylcarbazol-9-yl)-1,3,5-triazin-2-yl]-9-(4-methylphenyl)carbazole
CID 137401866
9-phenyl-3-(3'-phenylspiro[benzo[b]fluorene-11,9'-fluorene]-3-yl)carbazole
CID 138623650

Frequently Asked Questions

What is the IUPAC name of 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene]?
The IUPAC name of 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene] (CID 161485637) is 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene].
What is the SMILES notation for 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene]?
The canonical SMILES for 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene] is Cc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)N(c4nc(-c6ccccc6)nc(-c6ccccc6)n4)c4ccccc4[Si]54c5ccccc5-c5ccccc54)ccc32)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)N(c5nc(-c7ccccc7)nc(-c7ccccc7)n5)c5ccccc5C65c6ccccc6-c6ccccc65)ccc43)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(N3c4ccccc4[Si]4(c5ccccc5-c5ccccc54)c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc43)n2)cc1.
What is the InChIKey of 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene]?
The InChIKey is WEYATYVISHAJKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H41N5.C58H39N5Si.C57H37N5Si/c1-4-18-42(19-5-1)43-32-36-48(37-33-43)68-57-30-16-12-26-51(57)52-40-46(35-39-58(52)68)47-34-38-56-60(41-47)69(63-66-61(44-20-6-2-7-21-44)65-62(67-63)45-22-8-3-9-23-45)59-31-17-15-29-55(59)64(56)53-27-13-10-24-49(53)50-25-11-14-28-54(50)64;1-38-28-32-43(33-29-38)62-48-23-11-8-20-44(48)47-36-41(30-34-49(47)62)42-31-35-55-51(37-42)63(58-60-56(39-16-4-2-5-17-39)59-57(61-58)40-18-6-3-7-19-40)50-24-12-15-27-54(50)64(55)52-25-13-9-21-45(52)46-22-10-14-26-53(46)64;1-4-18-38(19-5-1)55-58-56(39-20-6-2-7-21-39)60-57(59-55)62-49-28-14-17-31-53(49)63(51-29-15-11-25-44(51)45-26-12-16-30-52(45)63)54-35-33-41(37-50(54)62)40-32-34-48-46(36-40)43-24-10-13-27-47(43)61(48)42-22-8-3-9-23-42/h1-41H;2-37H,1H3;1-37H.
What are the key properties of 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene]?
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene] has a molecular weight of 2534.18 g/mol, XLogP of 38.31, 16 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-methylphenyl)carbazol-3-yl]spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(9-phenylcarbazol-3-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene] is sourced from PubChem (CID 161485637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).