14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene

C50H38GeN4O — CID 155616483

IUPAC14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene
SMILESC[Ge]1(C)c2ccc(Oc3ccc4c5ccccc5n(-c5ccccn5)c4c3)cc2N2CN(c3c(-c4ccccc4)cccc3-c3ccccc3)c3cccc1c32
InChIInChI=1S/C50H38GeN4O/c1-51(2)42-29-27-37(56-36-26-28-41-40-19-9-10-23-44(40)55(46(41)31-36)48-25-11-12-30-52-48)32-47(42)54-33-53(45-24-14-22-43(51)50(45)54)49-38(34-15-5-3-6-16-34)20-13-21-39(49)35-17-7-4-8-18-35/h3-32H,33H2,1-2H3
InChIKeyXQJSEPWBBAMBJX-UHFFFAOYSA-N
MW783.49 g/mol
LogP11.69
Rot. Bonds6

About 14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene

14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene (PubChem CID 155616483) has the molecular formula C50H38GeN4O and a molecular weight of 783.49 g/mol. Its IUPAC name is 14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene.

Molecular Properties

Compound Name14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene
PubChem CID155616483
Molecular FormulaC50H38GeN4O
Molecular Weight783.49 g/mol
Exact Mass784.23
IUPAC Name14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene
SMILESC[Ge]1(C)c2ccc(Oc3ccc4c5ccccc5n(-c5ccccn5)c4c3)cc2N2CN(c3c(-c4ccccc4)cccc3-c3ccccc3)c3cccc1c32
InChIInChI=1S/C50H38GeN4O/c1-51(2)42-29-27-37(56-36-26-28-41-40-19-9-10-23-44(40)55(46(41)31-36)48-25-11-12-30-52-48)32-47(42)54-33-53(45-24-14-22-43(51)50(45)54)49-38(34-15-5-3-6-16-34)20-13-21-39(49)35-17-7-4-8-18-35/h3-32H,33H2,1-2H3
InChIKeyXQJSEPWBBAMBJX-UHFFFAOYSA-N
XLogP11.69
TPSA33.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500783.49
LogP ≤ 511.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene with MolForge

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Related Compounds

8,8,14-trimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene
CID 155616594
14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole]
CID 155616684
9-[4-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-2-pyridinyl]carbazole
CID 166007105
14-methyl-1',8'-diphenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9(16),10,12-hexaene-8,9'-thioxanthene]
CID 165374791
2-[2,6-bis(3,5-diphenylphenyl)phenyl]-5-methyl-4-phenyl-8-(9-pyridin-2-ylcarbazol-2-yl)oxy-1H-imidazo[5,1-c][1,4,2]benzodiazaborinine
CID 155616604
8,8-dimethyl-14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9(16),10,12-hexaene
CID 155616602
2-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]carbazole
CID 162704513
2-(2,6-diphenylphenyl)-4,4,5,5-tetramethyl-8-(9-pyridin-2-ylcarbazol-2-yl)oxy-1H-imidazo[1,5-a][1,4]benzazasiline
CID 155616628
9-[5-[2,6-di(carbazol-9-yl)phenyl]-4-methyl-2-pyridinyl]-2-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-1-yl]phenoxy]carbazole
CID 169288868
2-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-1-yl]phenoxy]-9-pyridin-2-yl-6-(2,3,5,6-tetradeuterio-4-methylphenyl)carbazole
CID 158273463
14-[2,6-bis(3,5-diphenylphenyl)phenyl]-4-[9-(4-tert-butyl-2-pyridinyl)carbazol-2-yl]oxy-8-oxa-1,14-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene
CID 155616582
2-[3-[1-(2,6-diphenylphenyl)-2H-imidazo[4,5-b]pyridin-3-yl]phenoxy]-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]carbazole
CID 162704571

Frequently Asked Questions

What is the IUPAC name of 14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene?
The IUPAC name of 14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene (CID 155616483) is 14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene.
What is the SMILES notation for 14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene?
The canonical SMILES for 14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene is C[Ge]1(C)c2ccc(Oc3ccc4c5ccccc5n(-c5ccccn5)c4c3)cc2N2CN(c3c(-c4ccccc4)cccc3-c3ccccc3)c3cccc1c32.
What is the InChIKey of 14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene?
The InChIKey is XQJSEPWBBAMBJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H38GeN4O/c1-51(2)42-29-27-37(56-36-26-28-41-40-19-9-10-23-44(40)55(46(41)31-36)48-25-11-12-30-52-48)32-47(42)54-33-53(45-24-14-22-43(51)50(45)54)49-38(34-15-5-3-6-16-34)20-13-21-39(49)35-17-7-4-8-18-35/h3-32H,33H2,1-2H3.
What are the key properties of 14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene?
14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene has a molecular weight of 783.49 g/mol, XLogP of 11.69, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 14-(2,6-diphenylphenyl)-8,8-dimethyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxy-1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene is sourced from PubChem (CID 155616483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).