11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide

C33H21N2OP — CID 121310218

IUPAC11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide
SMILESO=P1(c2ccccc2)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cccc2cccnc12
InChIInChI=1S/C33H21N2OP/c36-37(23-12-2-1-3-13-23)31-18-7-5-15-25(31)27-20-30-26(21-32(27)37)24-14-4-6-16-28(24)35(30)29-17-8-10-22-11-9-19-34-33(22)29/h1-21H
InChIKeyXHELSOGEBQJTOT-UHFFFAOYSA-N
MW492.52 g/mol
LogP6.95
Rot. Bonds2

About 11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide

11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide (PubChem CID 121310218) has the molecular formula C33H21N2OP and a molecular weight of 492.52 g/mol. Its IUPAC name is 11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide.

Molecular Properties

Compound Name11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide
PubChem CID121310218
Molecular FormulaC33H21N2OP
Molecular Weight492.52 g/mol
Exact Mass492.14
IUPAC Name11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide
SMILESO=P1(c2ccccc2)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cccc2cccnc12
InChIInChI=1S/C33H21N2OP/c36-37(23-12-2-1-3-13-23)31-18-7-5-15-25(31)27-20-30-26(21-32(27)37)24-14-4-6-16-28(24)35(30)29-17-8-10-22-11-9-19-34-33(22)29/h1-21H
InChIKeyXHELSOGEBQJTOT-UHFFFAOYSA-N
XLogP6.95
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500492.52
LogP ≤ 56.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-(4-naphthalen-2-ylphenyl)-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;11-phenyl-5-(4-quinolin-7-ylphenyl)phosphindolo[3,2-b]carbazole 11-oxide;11-phenyl-5-(4-quinolin-8-ylphenyl)phosphindolo[3,2-b]carbazole 11-oxide
CID 157358110
11-phenyl-5-(4-quinolin-7-ylphenyl)phosphindolo[3,2-b]carbazole 11-oxide
CID 121310222
5-(7,10-diphenylfluoranthen-8-yl)-11-phenylphosphindolo[3,2-b]carbazole 11-oxide
CID 121310337
5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide
CID 158880248
5,11-diphenylphosphindolo[3,2-b]carbazole 11-oxide;5-naphthalen-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-naphthalen-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;11-phenyl-5-(2-phenylphenyl)phosphindolo[3,2-b]carbazole 11-oxide
CID 158937555
5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-11-phenylphosphindolo[3,2-b]carbazole 11-oxide
CID 121310284
5-[2,6-bis(4-phenylphenyl)pyrimidin-4-yl]-11-phenylphosphindolo[3,2-b]carbazole 11-oxide
CID 121310206
11-(1,10-phenanthrolin-3-yl)-12-phenylphosphindolo[2,3-a]carbazole 12-oxide
CID 121310442
12-phenyl-5-(4-phenylquinazolin-2-yl)phosphindolo[3,2-c]carbazole 12-oxide;12-phenyl-5-quinazolin-2-ylphosphindolo[3,2-c]carbazole 12-oxide;12-phenyl-5-quinolin-8-ylphosphindolo[3,2-c]carbazole 12-oxide
CID 160502776
5-[4-(9,9-dimethyl-7-naphthalen-1-ylfluoren-2-yl)phenyl]-11-phenylphosphindolo[3,2-b]carbazole 11-oxide
CID 121310310
N-[4-[4-(11-oxo-11-phenylphosphindolo[3,2-b]carbazol-5-yl)phenyl]phenyl]-N,4-diphenylaniline
CID 121310285
11,12-di(quinolin-8-yl)indolo[2,3-a]carbazole
CID 58184810

Frequently Asked Questions

What is the IUPAC name of 11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide?
The IUPAC name of 11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide (CID 121310218) is 11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide.
What is the SMILES notation for 11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide?
The canonical SMILES for 11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide is O=P1(c2ccccc2)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cccc2cccnc12.
What is the InChIKey of 11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide?
The InChIKey is XHELSOGEBQJTOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H21N2OP/c36-37(23-12-2-1-3-13-23)31-18-7-5-15-25(31)27-20-30-26(21-32(27)37)24-14-4-6-16-28(24)35(30)29-17-8-10-22-11-9-19-34-33(22)29/h1-21H.
What are the key properties of 11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide?
11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide has a molecular weight of 492.52 g/mol, XLogP of 6.95, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide is sourced from PubChem (CID 121310218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).