11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide

C34H22NOP — CID 121310385

IUPAC11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide
SMILESO=P1(c2ccccc2)c2ccccc2-c2ccc3c4ccccc4n(-c4cccc5ccccc45)c3c21
InChIInChI=1S/C34H22NOP/c36-37(24-13-2-1-3-14-24)32-20-9-7-17-27(32)29-22-21-28-26-16-6-8-18-31(26)35(33(28)34(29)37)30-19-10-12-23-11-4-5-15-25(23)30/h1-22H
InChIKeySBLZAUMDDRHEQV-UHFFFAOYSA-N
MW491.53 g/mol
LogP7.56
Rot. Bonds2

About 11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide

11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide (PubChem CID 121310385) has the molecular formula C34H22NOP and a molecular weight of 491.53 g/mol. Its IUPAC name is 11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide.

Molecular Properties

Compound Name11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide
PubChem CID121310385
Molecular FormulaC34H22NOP
Molecular Weight491.53 g/mol
Exact Mass491.14
IUPAC Name11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide
SMILESO=P1(c2ccccc2)c2ccccc2-c2ccc3c4ccccc4n(-c4cccc5ccccc45)c3c21
InChIInChI=1S/C34H22NOP/c36-37(24-13-2-1-3-14-24)32-20-9-7-17-27(32)29-22-21-28-26-16-6-8-18-31(26)35(33(28)34(29)37)30-19-10-12-23-11-4-5-15-25(23)30/h1-22H
InChIKeySBLZAUMDDRHEQV-UHFFFAOYSA-N
XLogP7.56
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500491.53
LogP ≤ 57.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-naphthalen-1-yl-24-phenyl-3-aza-24λ5-phosphahexacyclo[11.11.0.02,10.04,9.014,23.017,22]tetracosa-1(13),2(10),4,6,8,11,14(23),15,17,19,21-undecaene 24-oxide
CID 121310531
3-naphthalen-1-yl-14-phenyl-3-aza-14λ5-phosphahexacyclo[11.11.0.02,10.04,9.015,24.016,21]tetracosa-1(13),2(10),4,6,8,11,15(24),16,18,20,22-undecaene 14-oxide
CID 121310899
12-phenyl-11-(3-phenylphenyl)phosphindolo[2,3-a]carbazole 12-oxide
CID 121310386
12-phenyl-11-[4-(9-phenylcarbazol-2-yl)phenyl]phosphindolo[2,3-a]carbazole 12-oxide
CID 121310510
12-phenyl-11-[4-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phosphindolo[2,3-a]carbazole 12-oxide
CID 121310471
12-phenyl-11-[4-(4-phenylphenyl)quinazolin-2-yl]phosphindolo[2,3-a]carbazole 12-oxide
CID 121310411
11-(1,10-phenanthrolin-3-yl)-12-phenylphosphindolo[2,3-a]carbazole 12-oxide
CID 121310442
11-[4-(9,9-dimethylfluoren-4-yl)phenyl]-12-phenylphosphindolo[2,3-a]carbazole 12-oxide
CID 121310437
11-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-12-phenylphosphindolo[2,3-a]carbazole 12-oxide;11-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-12-phenylphosphindolo[2,3-a]carbazole 12-oxide;N-[4-[4-(12-oxo-12-phenylphosphindolo[2,3-a]carbazol-11-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 159948216
9-naphthalen-1-yl-1-(9-naphthalen-1-ylcarbazol-1-yl)carbazole
CID 134507274
5-chrysen-3-yl-12-phenylphosphindolo[3,2-c]carbazole 12-oxide
CID 121310710
24-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-3-phenyl-24-aza-3λ5-phosphahexacyclo[11.11.0.02,10.04,9.014,23.017,22]tetracosa-1(13),2(10),4,6,8,11,14(23),15,17,19,21-undecaene 3-oxide
CID 121310541

Frequently Asked Questions

What is the IUPAC name of 11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide?
The IUPAC name of 11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide (CID 121310385) is 11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide.
What is the SMILES notation for 11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide?
The canonical SMILES for 11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide is O=P1(c2ccccc2)c2ccccc2-c2ccc3c4ccccc4n(-c4cccc5ccccc45)c3c21.
What is the InChIKey of 11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide?
The InChIKey is SBLZAUMDDRHEQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H22NOP/c36-37(24-13-2-1-3-14-24)32-20-9-7-17-27(32)29-22-21-28-26-16-6-8-18-31(26)35(33(28)34(29)37)30-19-10-12-23-11-4-5-15-25(23)30/h1-22H.
What are the key properties of 11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide?
11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide has a molecular weight of 491.53 g/mol, XLogP of 7.56, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide is sourced from PubChem (CID 121310385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).