6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one

C195H136N10O6Si2 — CID 161189686

IUPAC6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one
SMILESCc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(C)ccc1N2c1ccc2c(c1)C(=O)N(c1ccccc1)C2.O=C1c2cc(N3c4ccccc4C4(c5ccccc5-c5ccccc54)c4ccccc43)ccc2CN1c1ccccc1.O=C1c2cc(N3c4ccccc4C4(c5ccccc5Oc5ccccc54)c4ccccc43)ccc2CN1c1ccccc1.O=C1c2cc(N3c4ccccc4[Si](c4ccccc4)(c4ccccc4)c4ccccc43)ccc2CN1c1ccccc1.O=C1c2cc(N3c4ccccc4[Si]4(c5ccccc5-c5ccccc54)c4ccccc43)ccc2CN1c1ccccc1
InChIInChI=1S/C41H30N2O.C39H26N2O2.C39H26N2O.C38H26N2OSi.C38H28N2OSi/c1-26-16-20-38-36(22-26)41(34-14-8-6-12-31(34)32-13-7-9-15-35(32)41)37-23-27(2)17-21-39(37)43(38)30-19-18-28-25-42(40(44)33(28)24-30)29-10-4-3-5-11-29;42-38-29-24-28(23-22-26(29)25-40(38)27-12-2-1-3-13-27)41-34-18-8-4-14-30(34)39(31-15-5-9-19-35(31)41)32-16-6-10-20-36(32)43-37-21-11-7-17-33(37)39;42-38-31-24-28(23-22-26(31)25-40(38)27-12-2-1-3-13-27)41-36-20-10-8-18-34(36)39(35-19-9-11-21-37(35)41)32-16-6-4-14-29(32)30-15-5-7-17-33(30)39;41-38-31-24-28(23-22-26(31)25-39(38)27-12-2-1-3-13-27)40-32-16-6-10-20-36(32)42(37-21-11-7-17-33(37)40)34-18-8-4-14-29(34)30-15-5-9-19-35(30)42;41-38-33-26-30(25-24-28(33)27-39(38)29-14-4-1-5-15-29)40-34-20-10-12-22-36(34)42(31-16-6-2-7-17-31,32-18-8-3-9-19-32)37-23-13-11-21-35(37)40/h3-24H,25H2,1-2H3;1-24H,25H2;2*1-24H,25H2;1-26H,27H2
InChIKeyUTNXYSSPOVLBNR-UHFFFAOYSA-N
MW2771.47 g/mol
LogP39.72
Rot. Bonds12

About 6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one

6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one (PubChem CID 161189686) has the molecular formula C195H136N10O6Si2 and a molecular weight of 2771.47 g/mol. Its IUPAC name is 6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one.

Molecular Properties

Compound Name6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one
PubChem CID161189686
Molecular FormulaC195H136N10O6Si2
Molecular Weight2771.47 g/mol
Exact Mass2769.02
IUPAC Name6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one
SMILESCc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(C)ccc1N2c1ccc2c(c1)C(=O)N(c1ccccc1)C2.O=C1c2cc(N3c4ccccc4C4(c5ccccc5-c5ccccc54)c4ccccc43)ccc2CN1c1ccccc1.O=C1c2cc(N3c4ccccc4C4(c5ccccc5Oc5ccccc54)c4ccccc43)ccc2CN1c1ccccc1.O=C1c2cc(N3c4ccccc4[Si](c4ccccc4)(c4ccccc4)c4ccccc43)ccc2CN1c1ccccc1.O=C1c2cc(N3c4ccccc4[Si]4(c5ccccc5-c5ccccc54)c4ccccc43)ccc2CN1c1ccccc1
InChIInChI=1S/C41H30N2O.C39H26N2O2.C39H26N2O.C38H26N2OSi.C38H28N2OSi/c1-26-16-20-38-36(22-26)41(34-14-8-6-12-31(34)32-13-7-9-15-35(32)41)37-23-27(2)17-21-39(37)43(38)30-19-18-28-25-42(40(44)33(28)24-30)29-10-4-3-5-11-29;42-38-29-24-28(23-22-26(29)25-40(38)27-12-2-1-3-13-27)41-34-18-8-4-14-30(34)39(31-15-5-9-19-35(31)41)32-16-6-10-20-36(32)43-37-21-11-7-17-33(37)39;42-38-31-24-28(23-22-26(31)25-40(38)27-12-2-1-3-13-27)41-36-20-10-8-18-34(36)39(35-19-9-11-21-37(35)41)32-16-6-4-14-29(32)30-15-5-7-17-33(30)39;41-38-31-24-28(23-22-26(31)25-39(38)27-12-2-1-3-13-27)40-32-16-6-10-20-36(32)42(37-21-11-7-17-33(37)40)34-18-8-4-14-29(34)30-15-5-9-19-35(30)42;41-38-33-26-30(25-24-28(33)27-39(38)29-14-4-1-5-15-29)40-34-20-10-12-22-36(34)42(31-16-6-2-7-17-31,32-18-8-3-9-19-32)37-23-13-11-21-35(37)40/h3-24H,25H2,1-2H3;1-24H,25H2;2*1-24H,25H2;1-26H,27H2
InChIKeyUTNXYSSPOVLBNR-UHFFFAOYSA-N
XLogP39.72
TPSA126.98 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds12
Heavy Atoms213
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002771.47
LogP ≤ 539.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

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

Analyze 6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one with MolForge

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Related Compounds

7-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2,4-dimethylisoquinolin-1-one;2,4-dimethyl-7-spiro[acridine-9,9'-fluorene]-10-ylisoquinolin-1-one;2,4-dimethyl-7-spiro[acridine-9,9'-xanthene]-10-ylisoquinolin-1-one;2,4-dimethyl-7-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-ylisoquinolin-1-one;7-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2,4-dimethylisoquinolin-1-one
CID 159453482
10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline]
CID 158981211
5,10-diphenyl-10-(4-spiro[acridine-9,9'-fluorene]-10-ylphenyl)benzo[b][1,4]benzazasiline
CID 140886971
2,7-dimethyl-10-(5,10,10-triphenylbenzo[b][1,4]benzophosphasilin-2-yl)spiro[acridine-9,9'-fluorene];sulfane;10-(5,10,10-triphenylbenzo[b][1,4]benzophosphasilin-2-yl)-9H-acridine;bis(10-(5,10,10-triphenylbenzo[b][1,4]benzophosphasilin-2-yl)spiro[acridine-9,9'-fluorene]);dihydrate
CID 161341418
14-(3',7'-dimethyl-5,5'-spirobi[benzo[b][1]benzosilole]-3-yl)spiro[10-thia-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,9'-xanthene]
CID 177278079
2',7'-dimethyl-7-(5,5'-spirobi[benzo[b][1]benzosilole]-3-yl)spiro[benzo[a]acridine-12,9'-xanthene]
CID 177278379
21-(3',7'-dimethyl-5,5'-spirobi[benzo[b][1]benzosilole]-3-yl)-10,10-dimethylspiro[21-azapentacyclo[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 177278238
CID 158303939
CID 158303939
9,9-dimethyl-10-spiro[benzo[b][1,4]benzoxasiline-10,5'-benzo[b][1]benzosilole]-3'-ylacridine
CID 147956721
2,7,10,10-tetramethyl-5'-(5,5'-spirobi[benzo[b][1]benzosilole]-3-yl)spiro[anthracene-9,12'-benzo[b]acridine]
CID 177278200
2',7'-dimethyl-21-(5,5'-spirobi[benzo[b][1]benzosilole]-3-yl)spiro[10-oxa-21-azapentacyclo[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 177278267
6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)-3,4-dihydro-2H-naphthalen-1-one
CID 159841201

Frequently Asked Questions

What is the IUPAC name of 6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one?
The IUPAC name of 6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one (CID 161189686) is 6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one.
What is the SMILES notation for 6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one?
The canonical SMILES for 6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one is Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(C)ccc1N2c1ccc2c(c1)C(=O)N(c1ccccc1)C2.O=C1c2cc(N3c4ccccc4C4(c5ccccc5-c5ccccc54)c4ccccc43)ccc2CN1c1ccccc1.O=C1c2cc(N3c4ccccc4C4(c5ccccc5Oc5ccccc54)c4ccccc43)ccc2CN1c1ccccc1.O=C1c2cc(N3c4ccccc4[Si](c4ccccc4)(c4ccccc4)c4ccccc43)ccc2CN1c1ccccc1.O=C1c2cc(N3c4ccccc4[Si]4(c5ccccc5-c5ccccc54)c4ccccc43)ccc2CN1c1ccccc1.
What is the InChIKey of 6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one?
The InChIKey is UTNXYSSPOVLBNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H30N2O.C39H26N2O2.C39H26N2O.C38H26N2OSi.C38H28N2OSi/c1-26-16-20-38-36(22-26)41(34-14-8-6-12-31(34)32-13-7-9-15-35(32)41)37-23-27(2)17-21-39(37)43(38)30-19-18-28-25-42(40(44)33(28)24-30)29-10-4-3-5-11-29;42-38-29-24-28(23-22-26(29)25-40(38)27-12-2-1-3-13-27)41-34-18-8-4-14-30(34)39(31-15-5-9-19-35(31)41)32-16-6-10-20-36(32)43-37-21-11-7-17-33(37)39;42-38-31-24-28(23-22-26(31)25-40(38)27-12-2-1-3-13-27)41-36-20-10-8-18-34(36)39(35-19-9-11-21-37(35)41)32-16-6-4-14-29(32)30-15-5-7-17-33(30)39;41-38-31-24-28(23-22-26(31)25-39(38)27-12-2-1-3-13-27)40-32-16-6-10-20-36(32)42(37-21-11-7-17-33(37)40)34-18-8-4-14-29(34)30-15-5-9-19-35(30)42;41-38-33-26-30(25-24-28(33)27-39(38)29-14-4-1-5-15-29)40-34-20-10-12-22-36(34)42(31-16-6-2-7-17-31,32-18-8-3-9-19-32)37-23-13-11-21-35(37)40/h3-24H,25H2,1-2H3;1-24H,25H2;2*1-24H,25H2;1-26H,27H2.
What are the key properties of 6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one?
6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one has a molecular weight of 2771.47 g/mol, XLogP of 39.72, 12 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one is sourced from PubChem (CID 161189686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).