trilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene

C144H166BrClLi3Si6+3 — CID 162267525

IUPACtrilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene
SMILESBrc1cccc2c1CC=C2.C1=Cc2cccc(-c3ccccc3-c3ccccc3)c2C1.CCCCC1=CC([Si](C)(C)[Si](C)(C)C2=CCc3c2cccc3-c2ccccc2-c2ccccc2)C=C1.CCCCC1CCC([Si](C)(C)[Si](C)(C)C2CCC3C(c4ccccc4-c4ccccc4)CCCC32)C1.C[Si](C)(Cl)[Si](C)(C)C1=CCc2c1cccc2-c1ccccc1-c1ccccc1.[Li+].[Li+].[Li+].c1ccc(-c2ccccc2C2CCCC3CCCC32)cc1
InChIInChI=1S/C34H52Si2.C34H40Si2.C25H27ClSi2.C21H24.C21H16.C9H7Br.3Li/c2*1-6-7-14-26-21-22-28(25-26)35(2,3)36(4,5)34-24-23-32-31(19-13-20-33(32)34)30-18-12-11-17-29(30)27-15-9-8-10-16-27;1-27(2,28(3,4)26)25-18-17-23-22(15-10-16-24(23)25)21-14-9-8-13-20(21)19-11-6-5-7-12-19;2*1-2-8-16(9-3-1)18-12-4-5-13-20(18)21-15-7-11-17-10-6-14-19(17)21;10-9-6-2-4-7-3-1-5-8(7)9;;;/h8-12,15-18,26,28,31-34H,6-7,13-14,19-25H2,1-5H3;8-13,15-22,24-25,28H,6-7,14,23H2,1-5H3;5-16,18H,17H2,1-4H3;1-5,8-9,12-13,17,19,21H,6-7,10-11,14-15H2;1-13,15H,14H2;1-4,6H,5H2;;;/q;;;;;;3*+1
InChIKeyLAZNNRNOVCFHDA-UHFFFAOYSA-N
MW2201.61 g/mol
LogP34.31
Rot. Bonds24

About trilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene

trilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene (PubChem CID 162267525) has the molecular formula C144H166BrClLi3Si6+3 and a molecular weight of 2201.61 g/mol. Its IUPAC name is trilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene.

Molecular Properties

Compound Nametrilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene
PubChem CID162267525
Molecular FormulaC144H166BrClLi3Si6+3
Molecular Weight2201.61 g/mol
Exact Mass2198.09
IUPAC Nametrilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene
SMILESBrc1cccc2c1CC=C2.C1=Cc2cccc(-c3ccccc3-c3ccccc3)c2C1.CCCCC1=CC([Si](C)(C)[Si](C)(C)C2=CCc3c2cccc3-c2ccccc2-c2ccccc2)C=C1.CCCCC1CCC([Si](C)(C)[Si](C)(C)C2CCC3C(c4ccccc4-c4ccccc4)CCCC32)C1.C[Si](C)(Cl)[Si](C)(C)C1=CCc2c1cccc2-c1ccccc1-c1ccccc1.[Li+].[Li+].[Li+].c1ccc(-c2ccccc2C2CCCC3CCCC32)cc1
InChIInChI=1S/C34H52Si2.C34H40Si2.C25H27ClSi2.C21H24.C21H16.C9H7Br.3Li/c2*1-6-7-14-26-21-22-28(25-26)35(2,3)36(4,5)34-24-23-32-31(19-13-20-33(32)34)30-18-12-11-17-29(30)27-15-9-8-10-16-27;1-27(2,28(3,4)26)25-18-17-23-22(15-10-16-24(23)25)21-14-9-8-13-20(21)19-11-6-5-7-12-19;2*1-2-8-16(9-3-1)18-12-4-5-13-20(18)21-15-7-11-17-10-6-14-19(17)21;10-9-6-2-4-7-3-1-5-8(7)9;;;/h8-12,15-18,26,28,31-34H,6-7,13-14,19-25H2,1-5H3;8-13,15-22,24-25,28H,6-7,14,23H2,1-5H3;5-16,18H,17H2,1-4H3;1-5,8-9,12-13,17,19,21H,6-7,10-11,14-15H2;1-13,15H,14H2;1-4,6H,5H2;;;/q;;;;;;3*+1
InChIKeyLAZNNRNOVCFHDA-UHFFFAOYSA-N
XLogP34.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds24
Heavy Atoms155
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002201.61
LogP ≤ 534.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze trilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene with MolForge

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Frequently Asked Questions

What is the IUPAC name of trilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene?
The IUPAC name of trilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene (CID 162267525) is trilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene.
What is the SMILES notation for trilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene?
The canonical SMILES for trilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene is Brc1cccc2c1CC=C2.C1=Cc2cccc(-c3ccccc3-c3ccccc3)c2C1.CCCCC1=CC([Si](C)(C)[Si](C)(C)C2=CCc3c2cccc3-c2ccccc2-c2ccccc2)C=C1.CCCCC1CCC([Si](C)(C)[Si](C)(C)C2CCC3C(c4ccccc4-c4ccccc4)CCCC32)C1.C[Si](C)(Cl)[Si](C)(C)C1=CCc2c1cccc2-c1ccccc1-c1ccccc1.[Li+].[Li+].[Li+].c1ccc(-c2ccccc2C2CCCC3CCCC32)cc1.
What is the InChIKey of trilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene?
The InChIKey is LAZNNRNOVCFHDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H52Si2.C34H40Si2.C25H27ClSi2.C21H24.C21H16.C9H7Br.3Li/c2*1-6-7-14-26-21-22-28(25-26)35(2,3)36(4,5)34-24-23-32-31(19-13-20-33(32)34)30-18-12-11-17-29(30)27-15-9-8-10-16-27;1-27(2,28(3,4)26)25-18-17-23-22(15-10-16-24(23)25)21-14-9-8-13-20(21)19-11-6-5-7-12-19;2*1-2-8-16(9-3-1)18-12-4-5-13-20(18)21-15-7-11-17-10-6-14-19(17)21;10-9-6-2-4-7-3-1-5-8(7)9;;;/h8-12,15-18,26,28,31-34H,6-7,13-14,19-25H2,1-5H3;8-13,15-22,24-25,28H,6-7,14,23H2,1-5H3;5-16,18H,17H2,1-4H3;1-5,8-9,12-13,17,19,21H,6-7,10-11,14-15H2;1-13,15H,14H2;1-4,6H,5H2;;;/q;;;;;;3*+1.
What are the key properties of trilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene?
trilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene has a molecular weight of 2201.61 g/mol, XLogP of 34.31, 24 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trilithium;7-bromo-1H-indene;(3-butylcyclopenta-2,4-dien-1-yl)-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-[4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-dimethylsilane;chloro-[dimethyl-[4-(2-phenylphenyl)-3H-inden-1-yl]silyl]-dimethylsilane;4-(2-phenylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-(2-phenylphenyl)-1H-indene is sourced from PubChem (CID 162267525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).