9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine

C66H46FGeN3O — CID 140704713

IUPAC9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine
SMILESFc1ccc(-n2c3ccc(N(c4ccc(Oc5ccccc5)cc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3c3cc([Ge](c4ccccc4)(c4ccccc4)c4ccccc4)ccc32)cc1
InChIInChI=1S/C66H46FGeN3O/c67-47-30-33-54(34-31-47)71-64-41-32-51(68(48-18-6-1-7-19-48,49-20-8-2-9-21-49)50-22-10-3-11-23-50)44-60(64)62-46-56(38-43-66(62)71)69(53-35-39-58(40-36-53)72-57-26-14-5-15-27-57)55-37-42-65-61(45-55)59-28-16-17-29-63(59)70(65)52-24-12-4-13-25-52/h1-46H
InChIKeyZVZUYFBKMCHKOM-UHFFFAOYSA-N
MW988.72 g/mol
LogP14.66
Rot. Bonds11

About 9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine

9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine (PubChem CID 140704713) has the molecular formula C66H46FGeN3O and a molecular weight of 988.72 g/mol. Its IUPAC name is 9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine.

Molecular Properties

Compound Name9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine
PubChem CID140704713
Molecular FormulaC66H46FGeN3O
Molecular Weight988.72 g/mol
Exact Mass989.28
IUPAC Name9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine
SMILESFc1ccc(-n2c3ccc(N(c4ccc(Oc5ccccc5)cc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3c3cc([Ge](c4ccccc4)(c4ccccc4)c4ccccc4)ccc32)cc1
InChIInChI=1S/C66H46FGeN3O/c67-47-30-33-54(34-31-47)71-64-41-32-51(68(48-18-6-1-7-19-48,49-20-8-2-9-21-49)50-22-10-3-11-23-50)44-60(64)62-46-56(38-43-66(62)71)69(53-35-39-58(40-36-53)72-57-26-14-5-15-27-57)55-37-42-65-61(45-55)59-28-16-17-29-63(59)70(65)52-24-12-4-13-25-52/h1-46H
InChIKeyZVZUYFBKMCHKOM-UHFFFAOYSA-N
XLogP14.66
TPSA22.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms72
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500988.72
LogP ≤ 514.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

9-(4-Methoxyphenyl)carbazole
CID 3110802
2-(3-Fluoro-4-methylphenyl)-1-(4-methoxyphenyl)indole
CID 71492038
9-(4-Phenoxyphenyl)carbazole
CID 68832496
N,N,N',N'-Tetrakis(4-methoxyphenyl)-9H-carbazole-3,6-diamine
CID 118643164
9-Spiro[fluorene-9,9'-xanthene]-2'-ylcarbazole
CID 139052249
9-ethyl-3-N,3-N,6-N,6-N-tetrakis(4-methoxyphenyl)carbazole-3,6-diamine
CID 154717251
(2-{3,6-Bis[bis(4-methoxyphenyl)amino]-9h-carbazol-9-yl}ethyl)phosphonic acid
CID 157868134
3,5-Di(9H-carbazol-9-yl)-N,N-bis(4-((6-((3-ethyloxetan-3-yl)methoxy)hexyl)oxy)phenyl)aniline
CID 162505705
9-[3-(4-fluorophenoxy)propyl]-9H-carbazole
CID 2290363
5-Fluoro-2-methyl-1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]indole
CID 16659555
(Z)-2-(3,5-difluorophenyl)-3-[9-(4-methoxyphenyl)carbazol-3-yl]prop-2-enenitrile
CID 18627191
(Z)-3-[9-(4-methoxyphenyl)carbazol-3-yl]-2-(2,3,4-trifluorophenyl)prop-2-enenitrile
CID 18627193

Frequently Asked Questions

What is the IUPAC name of 9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine?
The IUPAC name of 9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine (CID 140704713) is 9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine.
What is the SMILES notation for 9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine?
The canonical SMILES for 9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine is Fc1ccc(-n2c3ccc(N(c4ccc(Oc5ccccc5)cc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3c3cc([Ge](c4ccccc4)(c4ccccc4)c4ccccc4)ccc32)cc1.
What is the InChIKey of 9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine?
The InChIKey is ZVZUYFBKMCHKOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H46FGeN3O/c67-47-30-33-54(34-31-47)71-64-41-32-51(68(48-18-6-1-7-19-48,49-20-8-2-9-21-49)50-22-10-3-11-23-50)44-60(64)62-46-56(38-43-66(62)71)69(53-35-39-58(40-36-53)72-57-26-14-5-15-27-57)55-37-42-65-61(45-55)59-28-16-17-29-63(59)70(65)52-24-12-4-13-25-52/h1-46H.
What are the key properties of 9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine?
9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine has a molecular weight of 988.72 g/mol, XLogP of 14.66, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-fluorophenyl)-N-(4-phenoxyphenyl)-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine is sourced from PubChem (CID 140704713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).