N,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline

C192H140N6Si3 — CID 160555573

IUPACN,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc6c(c5)N(c5ccccc5)c5ccccc5[Si]6(c5ccccc5)c5ccccc5)cc4)c4cccc(-c5ccccc5)c4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccccc3N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c(c4)N(c4ccccc4)c4ccccc4[Si]5(c4ccccc4)c4ccccc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)N(c4ccccc4)c4ccccc4[Si]5(c4ccccc4)c4ccccc4)cc3)c3cccc(-c4ccccc4)c3)cc2)cc1
InChIInChI=1S/2C66H48N2Si.C60H44N2Si/c1-6-20-49(21-7-1)51-34-36-54(37-35-51)61-30-16-17-31-62(61)67(57-43-38-52(39-44-57)50-22-8-2-9-23-50)58-45-40-53(41-46-58)55-42-47-66-64(48-55)68(56-24-10-3-11-25-56)63-32-18-19-33-65(63)69(66,59-26-12-4-13-27-59)60-28-14-5-15-29-60;1-6-19-49(20-7-1)51-33-35-52(36-34-51)53-37-42-58(43-38-53)67(60-26-18-23-55(47-60)50-21-8-2-9-22-50)59-44-39-54(40-45-59)56-41-46-66-64(48-56)68(57-24-10-3-11-25-57)63-31-16-17-32-65(63)69(66,61-27-12-4-13-28-61)62-29-14-5-15-30-62;1-6-19-45(20-7-1)47-33-38-52(39-34-47)61(54-26-18-23-49(43-54)46-21-8-2-9-22-46)53-40-35-48(36-41-53)50-37-42-60-58(44-50)62(51-24-10-3-11-25-51)57-31-16-17-32-59(57)63(60,55-27-12-4-13-28-55)56-29-14-5-15-30-56/h2*1-48H;1-44H
InChIKeyQYQGLBFITMRHJS-UHFFFAOYSA-N
MW2615.53 g/mol
LogP43.29
Rot. Bonds29

About N,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline

N,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline (PubChem CID 160555573) has the molecular formula C192H140N6Si3 and a molecular weight of 2615.53 g/mol. Its IUPAC name is N,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline.

Molecular Properties

Compound NameN,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline
PubChem CID160555573
Molecular FormulaC192H140N6Si3
Molecular Weight2615.53 g/mol
Exact Mass2613.04
IUPAC NameN,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc6c(c5)N(c5ccccc5)c5ccccc5[Si]6(c5ccccc5)c5ccccc5)cc4)c4cccc(-c5ccccc5)c4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccccc3N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c(c4)N(c4ccccc4)c4ccccc4[Si]5(c4ccccc4)c4ccccc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)N(c4ccccc4)c4ccccc4[Si]5(c4ccccc4)c4ccccc4)cc3)c3cccc(-c4ccccc4)c3)cc2)cc1
InChIInChI=1S/2C66H48N2Si.C60H44N2Si/c1-6-20-49(21-7-1)51-34-36-54(37-35-51)61-30-16-17-31-62(61)67(57-43-38-52(39-44-57)50-22-8-2-9-23-50)58-45-40-53(41-46-58)55-42-47-66-64(48-55)68(56-24-10-3-11-25-56)63-32-18-19-33-65(63)69(66,59-26-12-4-13-27-59)60-28-14-5-15-29-60;1-6-19-49(20-7-1)51-33-35-52(36-34-51)53-37-42-58(43-38-53)67(60-26-18-23-55(47-60)50-21-8-2-9-22-50)59-44-39-54(40-45-59)56-41-46-66-64(48-56)68(57-24-10-3-11-25-57)63-31-16-17-32-65(63)69(66,61-27-12-4-13-28-61)62-29-14-5-15-30-62;1-6-19-45(20-7-1)47-33-38-52(39-34-47)61(54-26-18-23-49(43-54)46-21-8-2-9-22-46)53-40-35-48(36-41-53)50-37-42-60-58(44-50)62(51-24-10-3-11-25-51)57-31-16-17-32-59(57)63(60,55-27-12-4-13-28-55)56-29-14-5-15-30-56/h2*1-48H;1-44H
InChIKeyQYQGLBFITMRHJS-UHFFFAOYSA-N
XLogP43.29
TPSA19.44 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds29
Heavy Atoms201
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002615.53
LogP ≤ 543.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline with MolForge

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Related Compounds

3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline
CID 153459005
5,10,10-triphenyl-N-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[b][1,4]benzazasilin-3-amine;5,10,10-triphenyl-N-(3-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1,4]benzazasilin-3-amine;5,10,10-triphenyl-N-(4-phenylphenyl)-N-[3-(4-phenylphenyl)phenyl]benzo[b][1,4]benzazasilin-3-amine
CID 159227022
N,N-diphenyl-4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)aniline
CID 153458924
N,N-bis(4-naphthalen-1-ylphenyl)-4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)aniline;N-(4-naphthalen-2-ylphenyl)-4-phenyl-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;4-naphthalen-2-yl-N-phenyl-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline
CID 158352368
N-(4-naphthalen-2-ylphenyl)-N,5,10,10-tetraphenylbenzo[b][1,4]benzazasilin-3-amine
CID 153459046
N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-2-yl)phenyl]naphthalen-1-amine
CID 153459020
2-phenyl-N-(3-phenylphenyl)-N-[4-[3-(4-phenyl-N-(3-phenylphenyl)anilino)phenyl]phenyl]aniline
CID 118924577
N-dibenzofuran-3-yl-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]dibenzofuran-3-amine
CID 149206200
N-phenyl-N-[4-(2-phenylphenyl)phenyl]-3-[4-(5,6,11,11-tetraphenylindolo[2,3-b][1,4]benzazasilin-3-yl)phenyl]aniline
CID 153449211
2-phenyl-N,N-bis(3-phenylphenyl)aniline;4-(4-phenylphenyl)-N,N-bis[4-(4-phenylphenyl)phenyl]aniline;2-phenyl-N-(2-phenylphenyl)-N-(3-phenylphenyl)aniline
CID 157451830
N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-[4-(4-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-(3-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 158938491
N,6-diphenyl-N-[6-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)-2-pyridinyl]pyridin-2-amine
CID 140752711

Frequently Asked Questions

What is the IUPAC name of N,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline?
The IUPAC name of N,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline (CID 160555573) is N,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline.
What is the SMILES notation for N,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline?
The canonical SMILES for N,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline is c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc6c(c5)N(c5ccccc5)c5ccccc5[Si]6(c5ccccc5)c5ccccc5)cc4)c4cccc(-c5ccccc5)c4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccccc3N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c(c4)N(c4ccccc4)c4ccccc4[Si]5(c4ccccc4)c4ccccc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)N(c4ccccc4)c4ccccc4[Si]5(c4ccccc4)c4ccccc4)cc3)c3cccc(-c4ccccc4)c3)cc2)cc1.
What is the InChIKey of N,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline?
The InChIKey is QYQGLBFITMRHJS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C66H48N2Si.C60H44N2Si/c1-6-20-49(21-7-1)51-34-36-54(37-35-51)61-30-16-17-31-62(61)67(57-43-38-52(39-44-57)50-22-8-2-9-23-50)58-45-40-53(41-46-58)55-42-47-66-64(48-55)68(56-24-10-3-11-25-56)63-32-18-19-33-65(63)69(66,59-26-12-4-13-27-59)60-28-14-5-15-29-60;1-6-19-49(20-7-1)51-33-35-52(36-34-51)53-37-42-58(43-38-53)67(60-26-18-23-55(47-60)50-21-8-2-9-22-50)59-44-39-54(40-45-59)56-41-46-66-64(48-56)68(57-24-10-3-11-25-57)63-31-16-17-32-65(63)69(66,61-27-12-4-13-28-61)62-29-14-5-15-30-62;1-6-19-45(20-7-1)47-33-38-52(39-34-47)61(54-26-18-23-49(43-54)46-21-8-2-9-22-46)53-40-35-48(36-41-53)50-37-42-60-58(44-50)62(51-24-10-3-11-25-51)57-31-16-17-32-59(57)63(60,55-27-12-4-13-28-55)56-29-14-5-15-30-56/h2*1-48H;1-44H.
What are the key properties of N,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline?
N,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline has a molecular weight of 2615.53 g/mol, XLogP of 43.29, 29 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-bis(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]aniline is sourced from PubChem (CID 160555573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).