14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane

C151H98N6Si — CID 159228150

IUPAC14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane
SMILESC[Si](C)(C)c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6ccc(-c7nc8ccccc8c8c9c(ccc78)C7(c8ccccc8-c8ccccc87)c7ccccc7-9)cc6)c5c4)cc32)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5ccc6c7ccccc7n(-c7ccc(-c8cccc(-c9nc%10ccccc%10c%10c%11c(ccc9%10)C9(c%10ccccc%10-c%10ccccc%109)c9ccccc9-%11)c8)cc7)c6c5)cc43)c2)cc1
InChIInChI=1S/C80H49N3.C71H49N3Si/c1-2-18-50(19-3-1)53-21-17-23-58(47-53)83-74-35-15-9-27-62(74)64-43-39-55(49-76(64)83)54-38-42-63-61-26-8-14-34-73(61)82(75(63)48-54)57-40-36-51(37-41-57)52-20-16-22-56(46-52)79-67-44-45-71-78(77(67)66-29-7-13-33-72(66)81-79)65-28-6-12-32-70(65)80(71)68-30-10-4-24-59(68)60-25-5-11-31-69(60)80;1-75(2,3)49-36-34-48(35-37-49)74-65-27-15-9-19-53(65)55-39-31-46(43-67(55)74)45-30-38-54-52-18-8-14-26-64(52)73(66(54)42-45)47-32-28-44(29-33-47)70-58-40-41-62-69(68(58)57-21-7-13-25-63(57)72-70)56-20-6-12-24-61(56)71(62)59-22-10-4-16-50(59)51-17-5-11-23-60(51)71/h1-49H;4-43H,1-3H3
InChIKeyKSNZELPBVYANEP-UHFFFAOYSA-N
MW2024.57 g/mol
LogP38.40
Rot. Bonds11

About 14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane

14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane (PubChem CID 159228150) has the molecular formula C151H98N6Si and a molecular weight of 2024.57 g/mol. Its IUPAC name is 14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane.

Molecular Properties

Compound Name14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane
PubChem CID159228150
Molecular FormulaC151H98N6Si
Molecular Weight2024.57 g/mol
Exact Mass2022.76
IUPAC Name14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane
SMILESC[Si](C)(C)c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6ccc(-c7nc8ccccc8c8c9c(ccc78)C7(c8ccccc8-c8ccccc87)c7ccccc7-9)cc6)c5c4)cc32)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5ccc6c7ccccc7n(-c7ccc(-c8cccc(-c9nc%10ccccc%10c%10c%11c(ccc9%10)C9(c%10ccccc%10-c%10ccccc%109)c9ccccc9-%11)c8)cc7)c6c5)cc43)c2)cc1
InChIInChI=1S/C80H49N3.C71H49N3Si/c1-2-18-50(19-3-1)53-21-17-23-58(47-53)83-74-35-15-9-27-62(74)64-43-39-55(49-76(64)83)54-38-42-63-61-26-8-14-34-73(61)82(75(63)48-54)57-40-36-51(37-41-57)52-20-16-22-56(46-52)79-67-44-45-71-78(77(67)66-29-7-13-33-72(66)81-79)65-28-6-12-32-70(65)80(71)68-30-10-4-24-59(68)60-25-5-11-31-69(60)80;1-75(2,3)49-36-34-48(35-37-49)74-65-27-15-9-19-53(65)55-39-31-46(43-67(55)74)45-30-38-54-52-18-8-14-26-64(52)73(66(54)42-45)47-32-28-44(29-33-47)70-58-40-41-62-69(68(58)57-21-7-13-25-63(57)72-70)56-20-6-12-24-61(56)71(62)59-22-10-4-16-50(59)51-17-5-11-23-60(51)71/h1-49H;4-43H,1-3H3
InChIKeyKSNZELPBVYANEP-UHFFFAOYSA-N
XLogP38.40
TPSA45.50 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms158
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002024.57
LogP ≤ 538.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane with MolForge

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Related Compounds

14-[4-(4-carbazol-9-ylphenyl)phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];14-[4-(3,6-diphenylcarbazol-9-yl)phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]
CID 158277667
14-[3-[4-(2-ethylbenzimidazol-1-yl)phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]
CID 130394282
9,9-diphenyl-14-[3-[3-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]-15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene
CID 129124126
14-[3-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-xanthene];14-[3-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-xanthene]
CID 165058245
21-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]spiro[20-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene-10,9'-fluorene];21-[4-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]spiro[20-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene-10,9'-fluorene];21-[3-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]phenyl]spiro[20-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene-10,9'-fluorene]
CID 160963746
9-phenyl-2-(2-triphenylen-2-ylcarbazol-9-yl)carbazole;9-phenyl-2-[3-[2-(3-triphenylen-2-ylphenyl)carbazol-9-yl]phenyl]carbazole;9-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]-2-(3-triphenylen-2-ylphenyl)carbazole;9-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-2-(3-triphenylen-2-ylphenyl)carbazole
CID 160885222
6-[4-(3-carbazol-9-ylphenyl)phenyl]benzo[k]phenanthridine;6-[4-(4-carbazol-9-ylphenyl)phenyl]benzo[k]phenanthridine;6-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]benzo[k]phenanthridine
CID 158944758
3-[9-(3,5-diphenylphenyl)carbazol-2-yl]-9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole;[4-[2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[4-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-3-yl]-9-(3-phenylphenyl)carbazole;2-[9-[4-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-3-yl]-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 158934272
9,14-diphenyl-18-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16(21),17,19-decaene
CID 166584451
12'-[4-[4-(3-carbazol-9-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]spiro[fluorene-9,7'-indeno[1,2-a]carbazole]
CID 169014741
14-[4-[2,7-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-9-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene
CID 129124285
14-(3-carbazol-9-ylphenyl)spiro[15-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene-10,9'-fluorene];14-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene-10,9'-fluorene];14-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]spiro[15-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene-10,9'-fluorene]
CID 162197518

Frequently Asked Questions

What is the IUPAC name of 14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane?
The IUPAC name of 14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane (CID 159228150) is 14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane.
What is the SMILES notation for 14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane?
The canonical SMILES for 14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane is C[Si](C)(C)c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6ccc(-c7nc8ccccc8c8c9c(ccc78)C7(c8ccccc8-c8ccccc87)c7ccccc7-9)cc6)c5c4)cc32)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5ccc6c7ccccc7n(-c7ccc(-c8cccc(-c9nc%10ccccc%10c%10c%11c(ccc9%10)C9(c%10ccccc%10-c%10ccccc%109)c9ccccc9-%11)c8)cc7)c6c5)cc43)c2)cc1.
What is the InChIKey of 14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane?
The InChIKey is KSNZELPBVYANEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C80H49N3.C71H49N3Si/c1-2-18-50(19-3-1)53-21-17-23-58(47-53)83-74-35-15-9-27-62(74)64-43-39-55(49-76(64)83)54-38-42-63-61-26-8-14-34-73(61)82(75(63)48-54)57-40-36-51(37-41-57)52-20-16-22-56(46-52)79-67-44-45-71-78(77(67)66-29-7-13-33-72(66)81-79)65-28-6-12-32-70(65)80(71)68-30-10-4-24-59(68)60-25-5-11-31-69(60)80;1-75(2,3)49-36-34-48(35-37-49)74-65-27-15-9-19-53(65)55-39-31-46(43-67(55)74)45-30-38-54-52-18-8-14-26-64(52)73(66(54)42-45)47-32-28-44(29-33-47)70-58-40-41-62-69(68(58)57-21-7-13-25-63(57)72-70)56-20-6-12-24-61(56)71(62)59-22-10-4-16-50(59)51-17-5-11-23-60(51)71/h1-49H;4-43H,1-3H3.
What are the key properties of 14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane?
14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane has a molecular weight of 2024.57 g/mol, XLogP of 38.40, 11 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 14-[3-[4-[2-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene];trimethyl-[4-[2-[9-(4-spiro[15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene-9,9'-fluorene]-14-ylphenyl)carbazol-2-yl]carbazol-9-yl]phenyl]silane is sourced from PubChem (CID 159228150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).