10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole

C41H29NSi — CID 140775284

IUPAC10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole
SMILESCn1c2ccc(-c3ccc4c(c3)[Si](c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2c2c3ccccc3ccc21
InChIInChI=1S/C41H29NSi/c1-42-37-24-22-29(26-36(37)41-33-17-9-8-12-28(33)21-25-38(41)42)30-20-23-35-34-18-10-11-19-39(34)43(40(35)27-30,31-13-4-2-5-14-31)32-15-6-3-7-16-32/h2-27H,1H3
InChIKeyVPKZTDNQJDIUKF-UHFFFAOYSA-N
MW563.78 g/mol
LogP7.51
Rot. Bonds3

About 10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole

10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole (PubChem CID 140775284) has the molecular formula C41H29NSi and a molecular weight of 563.78 g/mol. Its IUPAC name is 10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole.

Molecular Properties

Compound Name10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole
PubChem CID140775284
Molecular FormulaC41H29NSi
Molecular Weight563.78 g/mol
Exact Mass563.21
IUPAC Name10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole
SMILESCn1c2ccc(-c3ccc4c(c3)[Si](c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2c2c3ccccc3ccc21
InChIInChI=1S/C41H29NSi/c1-42-37-24-22-29(26-36(37)41-33-17-9-8-12-28(33)21-25-38(41)42)30-20-23-35-34-18-10-11-19-39(34)43(40(35)27-30,31-13-4-2-5-14-31)32-15-6-3-7-16-32/h2-27H,1H3
InChIKeyVPKZTDNQJDIUKF-UHFFFAOYSA-N
XLogP7.51
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500563.78
LogP ≤ 57.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

14-methyl-9,9-diphenyl-14-aza-9-silahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene
CID 140775274
12-methyl-16,16-diphenyl-12-aza-16-silahexacyclo[11.11.0.02,11.04,9.015,23.017,22]tetracosa-1(24),2,4,6,8,10,13,15(23),17,19,21-undecaene
CID 140775315
2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-5-methylbenzo[b]carbazole;3-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-5-methylbenzo[b]carbazole;2-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-5-methylbenzo[b]carbazole;3-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-5-methylbenzo[b]carbazole;5-methyl-3-(5-phenylbenzo[b]phosphindol-3-yl)benzo[b]carbazole
CID 158148586
7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole
CID 134240713
7-methyl-10-[9-(4-phenylphenyl)carbazol-3-yl]benzo[c]carbazole
CID 138662741
7-methyl-10-(9-naphthalen-1-ylcarbazol-3-yl)benzo[c]carbazole
CID 138662750
7-methyl-10-(6H-naphthalen-6-id-2-yl)benzo[c]carbazole;yttrium
CID 58410512
5-(4-methylphenyl)-5-phenylnaphtho[2,3-b][1]benzosilole
CID 153488427
2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-9-methylcarbazole;2-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-9-methylcarbazole;9-methyl-2-(5-phenylbenzo[b]phosphindol-3-yl)carbazole
CID 157216212
2-(5-naphthalen-1-yl-5-phenylbenzo[b][1]benzosilol-3-yl)-4,6-diphenyl-1,3,5-triazine
CID 155787286
N-[4-(5,5-diphenylnaphtho[2,3-b][1]benzosilol-3-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 140719464
9-(7-dibenzothiophen-2-yl-5,5-diphenylbenzo[b][1]benzosilol-3-yl)-3,6-bis(4-naphthalen-1-ylphenyl)carbazole
CID 158495157

Frequently Asked Questions

What is the IUPAC name of 10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole?
The IUPAC name of 10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole (CID 140775284) is 10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole.
What is the SMILES notation for 10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole?
The canonical SMILES for 10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole is Cn1c2ccc(-c3ccc4c(c3)[Si](c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2c2c3ccccc3ccc21.
What is the InChIKey of 10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole?
The InChIKey is VPKZTDNQJDIUKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H29NSi/c1-42-37-24-22-29(26-36(37)41-33-17-9-8-12-28(33)21-25-38(41)42)30-20-23-35-34-18-10-11-19-39(34)43(40(35)27-30,31-13-4-2-5-14-31)32-15-6-3-7-16-32/h2-27H,1H3.
What are the key properties of 10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole?
10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole has a molecular weight of 563.78 g/mol, XLogP of 7.51, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-7-methylbenzo[c]carbazole is sourced from PubChem (CID 140775284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).