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

C190H136N6Si3 — CID 158352368

IUPACN,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
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)N(c4ccccc4)c4ccccc4[Si]5(c4ccccc4)c4ccccc4)cc3)c3ccc(-c4ccc5ccccc5c4)cc3)cc2)cc1.c1ccc(N(c2ccc(-c3ccc4c(c3)N(c3ccccc3)c3ccccc3[Si]4(c3ccccc3)c3ccccc3)cc2)c2ccc(-c3ccc4ccccc4c3)cc2)cc1.c1ccc(N2c3ccccc3[Si](c3ccccc3)(c3ccccc3)c3ccc(-c4ccc(N(c5ccc(-c6cccc7ccccc67)cc5)c5ccc(-c6cccc7ccccc67)cc5)cc4)cc32)cc1
InChIInChI=1S/C68H48N2Si.C64H46N2Si.C58H42N2Si/c1-4-22-55(23-5-1)70-65-32-14-15-33-67(65)71(59-24-6-2-7-25-59,60-26-8-3-9-27-60)68-47-40-54(48-66(68)70)49-34-41-56(42-35-49)69(57-43-36-52(37-44-57)63-30-16-20-50-18-10-12-28-61(50)63)58-45-38-53(39-46-58)64-31-17-21-51-19-11-13-29-62(51)64;1-5-17-47(18-6-1)49-31-38-56(39-32-49)65(57-40-33-50(34-41-57)53-30-29-48-19-13-14-20-52(48)45-53)58-42-35-51(36-43-58)54-37-44-64-62(46-54)66(55-21-7-2-8-22-55)61-27-15-16-28-63(61)67(64,59-23-9-3-10-24-59)60-25-11-4-12-26-60;1-5-19-49(20-6-1)59(51-36-31-44(32-37-51)47-30-29-43-17-13-14-18-46(43)41-47)52-38-33-45(34-39-52)48-35-40-58-56(42-48)60(50-21-7-2-8-22-50)55-27-15-16-28-57(55)61(58,53-23-9-3-10-24-53)54-25-11-4-12-26-54/h1-48H;1-46H;1-42H
InChIKeyGSLYNAUUYZHOLC-UHFFFAOYSA-N
MW2587.48 g/mol
LogP42.90
Rot. Bonds26

About 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

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 (PubChem CID 158352368) has the molecular formula C190H136N6Si3 and a molecular weight of 2587.48 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound NameN,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
PubChem CID158352368
Molecular FormulaC190H136N6Si3
Molecular Weight2587.48 g/mol
Exact Mass2585.01
IUPAC NameN,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
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)N(c4ccccc4)c4ccccc4[Si]5(c4ccccc4)c4ccccc4)cc3)c3ccc(-c4ccc5ccccc5c4)cc3)cc2)cc1.c1ccc(N(c2ccc(-c3ccc4c(c3)N(c3ccccc3)c3ccccc3[Si]4(c3ccccc3)c3ccccc3)cc2)c2ccc(-c3ccc4ccccc4c3)cc2)cc1.c1ccc(N2c3ccccc3[Si](c3ccccc3)(c3ccccc3)c3ccc(-c4ccc(N(c5ccc(-c6cccc7ccccc67)cc5)c5ccc(-c6cccc7ccccc67)cc5)cc4)cc32)cc1
InChIInChI=1S/C68H48N2Si.C64H46N2Si.C58H42N2Si/c1-4-22-55(23-5-1)70-65-32-14-15-33-67(65)71(59-24-6-2-7-25-59,60-26-8-3-9-27-60)68-47-40-54(48-66(68)70)49-34-41-56(42-35-49)69(57-43-36-52(37-44-57)63-30-16-20-50-18-10-12-28-61(50)63)58-45-38-53(39-46-58)64-31-17-21-51-19-11-13-29-62(51)64;1-5-17-47(18-6-1)49-31-38-56(39-32-49)65(57-40-33-50(34-41-57)53-30-29-48-19-13-14-20-52(48)45-53)58-42-35-51(36-43-58)54-37-44-64-62(46-54)66(55-21-7-2-8-22-55)61-27-15-16-28-63(61)67(64,59-23-9-3-10-24-59)60-25-11-4-12-26-60;1-5-19-49(20-6-1)59(51-36-31-44(32-37-51)47-30-29-43-17-13-14-18-46(43)41-47)52-38-33-45(34-39-52)48-35-40-58-56(42-48)60(50-21-7-2-8-22-50)55-27-15-16-28-57(55)61(58,53-23-9-3-10-24-53)54-25-11-4-12-26-54/h1-48H;1-46H;1-42H
InChIKeyGSLYNAUUYZHOLC-UHFFFAOYSA-N
XLogP42.90
TPSA19.44 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds26
Heavy Atoms199
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002587.48
LogP ≤ 542.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 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 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-naphthalen-2-ylphenyl)-N,5,10,10-tetraphenylbenzo[b][1,4]benzazasilin-3-amine
CID 153459046
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,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
N-(9,9-diphenylfluoren-2-yl)-N-(4-naphthalen-1-ylphenyl)-5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-amine
CID 153459019
N-(4-naphthalen-1-ylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-2-yl)phenyl]dibenzofuran-2-amine
CID 153260612
N-(4-phenylphenyl)-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-2-yl)phenyl]naphthalen-1-amine
CID 153459020
14,14-di(dibenzofuran-3-yl)-N,N-bis(4-naphthalen-1-ylphenyl)-21-phenyl-10-oxa-21-aza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4(9),5,7,11,15,17,19-nonaen-7-amine;14,14-di(dibenzofuran-3-yl)-N-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)-21-phenyl-10-oxa-21-aza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4(9),5,7,11,15,17,19-nonaen-7-amine;14,14-di(dibenzofuran-3-yl)-N-(4-naphthalen-2-ylphenyl)-21-phenyl-N-(4-phenylphenyl)-10-oxa-21-aza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4(9),5,7,11,15,17,19-nonaen-7-amine
CID 158173250
N,10,10-tri(dibenzofuran-3-yl)-N-(4-naphthalen-1-ylphenyl)-5-phenylbenzo[b][1,4]benzazasilin-3-amine
CID 147235673
N,N-diphenyl-4-[10-(4-phenylphenyl)-9H-acridin-2-yl]aniline;4-(7-naphthalen-1-yl-10-phenyl-9H-acridin-2-yl)-N,N-diphenylaniline;4-(7-naphthalen-2-yl-10-phenyl-9H-acridin-2-yl)-N,N-diphenylaniline
CID 158959762
N-dibenzofuran-3-yl-N-[4-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)phenyl]dibenzofuran-3-amine
CID 149206200

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is c1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)N(c4ccccc4)c4ccccc4[Si]5(c4ccccc4)c4ccccc4)cc3)c3ccc(-c4ccc5ccccc5c4)cc3)cc2)cc1.c1ccc(N(c2ccc(-c3ccc4c(c3)N(c3ccccc3)c3ccccc3[Si]4(c3ccccc3)c3ccccc3)cc2)c2ccc(-c3ccc4ccccc4c3)cc2)cc1.c1ccc(N2c3ccccc3[Si](c3ccccc3)(c3ccccc3)c3ccc(-c4ccc(N(c5ccc(-c6cccc7ccccc67)cc5)c5ccc(-c6cccc7ccccc67)cc5)cc4)cc32)cc1.
What is the InChIKey of 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?
The InChIKey is GSLYNAUUYZHOLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H48N2Si.C64H46N2Si.C58H42N2Si/c1-4-22-55(23-5-1)70-65-32-14-15-33-67(65)71(59-24-6-2-7-25-59,60-26-8-3-9-27-60)68-47-40-54(48-66(68)70)49-34-41-56(42-35-49)69(57-43-36-52(37-44-57)63-30-16-20-50-18-10-12-28-61(50)63)58-45-38-53(39-46-58)64-31-17-21-51-19-11-13-29-62(51)64;1-5-17-47(18-6-1)49-31-38-56(39-32-49)65(57-40-33-50(34-41-57)53-30-29-48-19-13-14-20-52(48)45-53)58-42-35-51(36-43-58)54-37-44-64-62(46-54)66(55-21-7-2-8-22-55)61-27-15-16-28-63(61)67(64,59-23-9-3-10-24-59)60-25-11-4-12-26-60;1-5-19-49(20-6-1)59(51-36-31-44(32-37-51)47-30-29-43-17-13-14-18-46(43)41-47)52-38-33-45(34-39-52)48-35-40-58-56(42-48)60(50-21-7-2-8-22-50)55-27-15-16-28-57(55)61(58,53-23-9-3-10-24-53)54-25-11-4-12-26-54/h1-48H;1-46H;1-42H.
What are the key properties of 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?
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 has a molecular weight of 2587.48 g/mol, XLogP of 42.90, 26 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 158352368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).