N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline

C143H116N6Si — CID 161157540

IUPACN-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
SMILESCc1c(C)n(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)cc2)c2ccccc12.Cc1c(C)n(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)cc2)c2ccccc12.Cc1c(C)n(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)[Si](C)(C)c4ccccc4-5)cc3)cc2)c2ccccc12
InChIInChI=1S/C49H40N2.C48H40N2Si.C46H36N2/c1-33-34(2)50(48-17-11-9-14-43(33)48)39-24-18-37(19-25-39)38-22-28-41(29-23-38)51(40-26-20-36(21-27-40)35-12-6-5-7-13-35)42-30-31-45-44-15-8-10-16-46(44)49(3,4)47(45)32-42;1-33-34(2)49(46-16-10-8-14-43(33)46)39-24-18-37(19-25-39)38-22-28-41(29-23-38)50(40-26-20-36(21-27-40)35-12-6-5-7-13-35)42-30-31-45-44-15-9-11-17-47(44)51(3,4)48(45)32-42;1-33-34(2)47(46-16-10-9-15-45(33)46)41-25-17-39(18-26-41)40-23-31-44(32-24-40)48(42-27-19-37(20-28-42)35-11-5-3-6-12-35)43-29-21-38(22-30-43)36-13-7-4-8-14-36/h2*5-32H,1-4H3;3-32H,1-2H3
InChIKeyUPMLXDHIZQBTOJ-UHFFFAOYSA-N
MW1946.63 g/mol
LogP37.93
Rot. Bonds19

About N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline

N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline (PubChem CID 161157540) has the molecular formula C143H116N6Si and a molecular weight of 1946.63 g/mol. Its IUPAC name is N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline.

Molecular Properties

Compound NameN-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
PubChem CID161157540
Molecular FormulaC143H116N6Si
Molecular Weight1946.63 g/mol
Exact Mass1944.90
IUPAC NameN-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
SMILESCc1c(C)n(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)cc2)c2ccccc12.Cc1c(C)n(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)cc2)c2ccccc12.Cc1c(C)n(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)[Si](C)(C)c4ccccc4-5)cc3)cc2)c2ccccc12
InChIInChI=1S/C49H40N2.C48H40N2Si.C46H36N2/c1-33-34(2)50(48-17-11-9-14-43(33)48)39-24-18-37(19-25-39)38-22-28-41(29-23-38)51(40-26-20-36(21-27-40)35-12-6-5-7-13-35)42-30-31-45-44-15-8-10-16-46(44)49(3,4)47(45)32-42;1-33-34(2)49(46-16-10-8-14-43(33)46)39-24-18-37(19-25-39)38-22-28-41(29-23-38)50(40-26-20-36(21-27-40)35-12-6-5-7-13-35)42-30-31-45-44-15-9-11-17-47(44)51(3,4)48(45)32-42;1-33-34(2)47(46-16-10-9-15-45(33)46)41-25-17-39(18-26-41)40-23-31-44(32-24-40)48(42-27-19-37(20-28-42)35-11-5-3-6-12-35)43-29-21-38(22-30-43)36-13-7-4-8-14-36/h2*5-32H,1-4H3;3-32H,1-2H3
InChIKeyUPMLXDHIZQBTOJ-UHFFFAOYSA-N
XLogP37.93
TPSA24.51 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds19
Heavy Atoms150
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001946.63
LogP ≤ 537.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline?
The IUPAC name of N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline (CID 161157540) is N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline.
What is the SMILES notation for N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline?
The canonical SMILES for N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline is Cc1c(C)n(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)cc2)c2ccccc12.Cc1c(C)n(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)cc2)c2ccccc12.Cc1c(C)n(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)[Si](C)(C)c4ccccc4-5)cc3)cc2)c2ccccc12.
What is the InChIKey of N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline?
The InChIKey is UPMLXDHIZQBTOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H40N2.C48H40N2Si.C46H36N2/c1-33-34(2)50(48-17-11-9-14-43(33)48)39-24-18-37(19-25-39)38-22-28-41(29-23-38)51(40-26-20-36(21-27-40)35-12-6-5-7-13-35)42-30-31-45-44-15-8-10-16-46(44)49(3,4)47(45)32-42;1-33-34(2)49(46-16-10-8-14-43(33)46)39-24-18-37(19-25-39)38-22-28-41(29-23-38)50(40-26-20-36(21-27-40)35-12-6-5-7-13-35)42-30-31-45-44-15-9-11-17-47(44)51(3,4)48(45)32-42;1-33-34(2)47(46-16-10-9-15-45(33)46)41-25-17-39(18-26-41)40-23-31-44(32-24-40)48(42-27-19-37(20-28-42)35-11-5-3-6-12-35)43-29-21-38(22-30-43)36-13-7-4-8-14-36/h2*5-32H,1-4H3;3-32H,1-2H3.
What are the key properties of N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline?
N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline has a molecular weight of 1946.63 g/mol, XLogP of 37.93, 19 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline is sourced from PubChem (CID 161157540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).