N-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine

C216H148N4O2S6Si8 — CID 158994897

IUPACN-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine
SMILESc1ccc(N(c2ccc3c(c2)[Si]2(c4ccccc4Sc4ccccc42)c2ccccc2[Si]3(c2ccccc2)c2ccccc2)c2ccc3c(c2)oc2ccccc23)cc1.c1ccc(N(c2ccc3c(c2)[Si]2(c4ccccc4Sc4ccccc42)c2ccccc2[Si]3(c2ccccc2)c2ccccc2)c2ccc3sc4ccccc4c3c2)cc1.c1ccc(N(c2ccc3c(c2)[Si]2(c4ccccc4Sc4ccccc42)c2ccccc2[Si]3(c2ccccc2)c2ccccc2)c2cccc3c2sc2ccccc23)cc1.c1ccc(N(c2ccc3c(c2)[Si]2(c4ccccc4Sc4ccccc42)c2ccccc2[Si]3(c2ccccc2)c2ccccc2)c2cccc3oc4ccccc4c23)cc1
InChIInChI=1S/2C54H37NOSSi2.2C54H37NS2Si2/c1-4-19-38(20-5-1)55(43-26-18-28-45-54(43)42-25-10-11-27-44(42)56-45)39-35-36-52-53(37-39)59(48-31-14-12-29-46(48)57-47-30-13-15-32-49(47)59)51-34-17-16-33-50(51)58(52,40-21-6-2-7-22-40)41-23-8-3-9-24-41;1-4-18-38(19-5-1)55(39-32-34-44-43-24-10-11-25-45(43)56-46(44)36-39)40-33-35-53-54(37-40)59(49-28-14-12-26-47(49)57-48-27-13-15-29-50(48)59)52-31-17-16-30-51(52)58(53,41-20-6-2-7-21-41)42-22-8-3-9-23-42;1-4-19-38(20-5-1)55(44-27-18-26-43-42-25-10-11-28-45(42)57-54(43)44)39-35-36-52-53(37-39)59(48-31-14-12-29-46(48)56-47-30-13-15-32-49(47)59)51-34-17-16-33-50(51)58(52,40-21-6-2-7-22-40)41-23-8-3-9-24-41;1-4-18-38(19-5-1)55(39-32-34-46-44(36-39)43-24-10-11-25-45(43)56-46)40-33-35-53-54(37-40)59(49-28-14-12-26-47(49)57-48-27-13-15-29-50(48)59)52-31-17-16-30-51(52)58(53,41-20-6-2-7-21-41)42-22-8-3-9-23-42/h4*1-37H
InChIKeyJQPRKRMVXGXRCP-UHFFFAOYSA-N
MW3248.68 g/mol
LogP35.29
Rot. Bonds20

About N-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine

N-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine (PubChem CID 158994897) has the molecular formula C216H148N4O2S6Si8 and a molecular weight of 3248.68 g/mol. Its IUPAC name is N-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine.

Molecular Properties

Compound NameN-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine
PubChem CID158994897
Molecular FormulaC216H148N4O2S6Si8
Molecular Weight3248.68 g/mol
Exact Mass3244.81
IUPAC NameN-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine
SMILESc1ccc(N(c2ccc3c(c2)[Si]2(c4ccccc4Sc4ccccc42)c2ccccc2[Si]3(c2ccccc2)c2ccccc2)c2ccc3c(c2)oc2ccccc23)cc1.c1ccc(N(c2ccc3c(c2)[Si]2(c4ccccc4Sc4ccccc42)c2ccccc2[Si]3(c2ccccc2)c2ccccc2)c2ccc3sc4ccccc4c3c2)cc1.c1ccc(N(c2ccc3c(c2)[Si]2(c4ccccc4Sc4ccccc42)c2ccccc2[Si]3(c2ccccc2)c2ccccc2)c2cccc3c2sc2ccccc23)cc1.c1ccc(N(c2ccc3c(c2)[Si]2(c4ccccc4Sc4ccccc42)c2ccccc2[Si]3(c2ccccc2)c2ccccc2)c2cccc3oc4ccccc4c23)cc1
InChIInChI=1S/2C54H37NOSSi2.2C54H37NS2Si2/c1-4-19-38(20-5-1)55(43-26-18-28-45-54(43)42-25-10-11-27-44(42)56-45)39-35-36-52-53(37-39)59(48-31-14-12-29-46(48)57-47-30-13-15-32-49(47)59)51-34-17-16-33-50(51)58(52,40-21-6-2-7-22-40)41-23-8-3-9-24-41;1-4-18-38(19-5-1)55(39-32-34-44-43-24-10-11-25-45(43)56-46(44)36-39)40-33-35-53-54(37-40)59(49-28-14-12-26-47(49)57-48-27-13-15-29-50(48)59)52-31-17-16-30-51(52)58(53,41-20-6-2-7-21-41)42-22-8-3-9-23-42;1-4-19-38(20-5-1)55(44-27-18-26-43-42-25-10-11-28-45(42)57-54(43)44)39-35-36-52-53(37-39)59(48-31-14-12-29-46(48)56-47-30-13-15-32-49(47)59)51-34-17-16-33-50(51)58(52,40-21-6-2-7-22-40)41-23-8-3-9-24-41;1-4-18-38(19-5-1)55(39-32-34-46-44(36-39)43-24-10-11-25-45(43)56-46)40-33-35-53-54(37-40)59(49-28-14-12-26-47(49)57-48-27-13-15-29-50(48)59)52-31-17-16-30-51(52)58(53,41-20-6-2-7-21-41)42-22-8-3-9-23-42/h4*1-37H
InChIKeyJQPRKRMVXGXRCP-UHFFFAOYSA-N
XLogP35.29
TPSA39.24 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds20
Heavy Atoms236
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003248.68
LogP ≤ 535.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze N-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine with MolForge

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Related Compounds

N-dibenzofuran-1-yl-N,5,5-triphenylspiro[benzo[b][1]benzosiline-10,9'-xanthene]-2-amine;N-dibenzofuran-3-yl-N,5,5-triphenylspiro[benzo[b][1]benzosiline-10,9'-xanthene]-2-amine;N-dibenzothiophen-2-yl-N,5,5-triphenylspiro[benzo[b][1]benzosiline-10,9'-xanthene]-2-amine;N-dibenzothiophen-4-yl-N,5,5-triphenylspiro[benzo[b][1]benzosiline-10,9'-xanthene]-2-amine
CID 158456992
N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine
CID 149201955
N-dibenzothiophen-4-yl-N-phenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17,19,21-dodecaen-5-amine
CID 146494386
N-phenyl-N-(10,10'-spirobi[benzo[b][1,4]benzothiasiline]-2-yl)dibenzofuran-3-amine
CID 148736996
1-N-dibenzofuran-3-yl-1-N,8-N,8-N-triphenyldibenzothiophene-1,8-diamine
CID 146580399
N-dibenzothiophen-2-yl-N-phenyl-10,10'-spirobi[benzo[b][1,4]benzothiasiline]-2-amine
CID 147492660
N-dibenzothiophen-2-yl-N-spiro[fluorene-9,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-thioxanthene]-2-amine;N-dibenzothiophen-4-yl-N-spiro[fluorene-9,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-thioxanthene]-2-amine;N,N-di(spiro[fluorene-9,9'-thioxanthene]-2-yl)dibenzofuran-3-amine
CID 159914253
N-(10',10'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,5'-silanthrene]-1'-yl)-N-[4-(2-phenylphenyl)phenyl]dibenzofuran-3-amine
CID 166012381
7-N-naphtho[1,2-b][1]benzothiol-4-yl-2-N,2-N,7-N-triphenyldibenzofuran-2,7-diamine
CID 170410120
1-N-dibenzothiophen-3-yl-1-N,8-N,8-N-triphenyldibenzofuran-1,8-diamine
CID 146573630
N-[3-[3-[dibenzofuran-3-yl(dibenzothiophen-4-yl)amino]phenyl]phenyl]-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-3-amine
CID 167086280
N-dibenzofuran-1-yl-N-[4-(20-oxa-9-thiapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-dibenzofuran-3-yl-N-[4-(20-oxa-9-thiapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-dibenzofuran-4-yl-N-[4-(20-oxa-9-thiapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-4-yl-N-[4-(20-oxa-9-thiapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine
CID 164954908

Frequently Asked Questions

What is the IUPAC name of N-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine?
The IUPAC name of N-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine (CID 158994897) is N-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine.
What is the SMILES notation for N-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine?
The canonical SMILES for N-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine is c1ccc(N(c2ccc3c(c2)[Si]2(c4ccccc4Sc4ccccc42)c2ccccc2[Si]3(c2ccccc2)c2ccccc2)c2ccc3c(c2)oc2ccccc23)cc1.c1ccc(N(c2ccc3c(c2)[Si]2(c4ccccc4Sc4ccccc42)c2ccccc2[Si]3(c2ccccc2)c2ccccc2)c2ccc3sc4ccccc4c3c2)cc1.c1ccc(N(c2ccc3c(c2)[Si]2(c4ccccc4Sc4ccccc42)c2ccccc2[Si]3(c2ccccc2)c2ccccc2)c2cccc3c2sc2ccccc23)cc1.c1ccc(N(c2ccc3c(c2)[Si]2(c4ccccc4Sc4ccccc42)c2ccccc2[Si]3(c2ccccc2)c2ccccc2)c2cccc3oc4ccccc4c23)cc1.
What is the InChIKey of N-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine?
The InChIKey is JQPRKRMVXGXRCP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C54H37NOSSi2.2C54H37NS2Si2/c1-4-19-38(20-5-1)55(43-26-18-28-45-54(43)42-25-10-11-27-44(42)56-45)39-35-36-52-53(37-39)59(48-31-14-12-29-46(48)57-47-30-13-15-32-49(47)59)51-34-17-16-33-50(51)58(52,40-21-6-2-7-22-40)41-23-8-3-9-24-41;1-4-18-38(19-5-1)55(39-32-34-44-43-24-10-11-25-45(43)56-46(44)36-39)40-33-35-53-54(37-40)59(49-28-14-12-26-47(49)57-48-27-13-15-29-50(48)59)52-31-17-16-30-51(52)58(53,41-20-6-2-7-21-41)42-22-8-3-9-23-42;1-4-19-38(20-5-1)55(44-27-18-26-43-42-25-10-11-28-45(42)57-54(43)44)39-35-36-52-53(37-39)59(48-31-14-12-29-46(48)56-47-30-13-15-32-49(47)59)51-34-17-16-33-50(51)58(52,40-21-6-2-7-22-40)41-23-8-3-9-24-41;1-4-18-38(19-5-1)55(39-32-34-46-44(36-39)43-24-10-11-25-45(43)56-46)40-33-35-53-54(37-40)59(49-28-14-12-26-47(49)57-48-27-13-15-29-50(48)59)52-31-17-16-30-51(52)58(53,41-20-6-2-7-21-41)42-22-8-3-9-23-42/h4*1-37H.
What are the key properties of N-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine?
N-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine has a molecular weight of 3248.68 g/mol, XLogP of 35.29, 20 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzothiophen-2-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-dibenzothiophen-4-yl-N,5',5'-triphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-1-amine;N-(5',5'-diphenylspiro[benzo[b][1,4]benzothiasiline-10,10'-silanthrene]-2'-yl)-N-phenyldibenzofuran-3-amine is sourced from PubChem (CID 158994897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).