10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide

C29H21N2OP — CID 140898941

IUPAC10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide
SMILESO=P1(c2ccccc2)c2ccccc2N(c2ccc(-c3cccnc3)cc2)c2ccccc21
InChIInChI=1S/C29H21N2OP/c32-33(25-10-2-1-3-11-25)28-14-6-4-12-26(28)31(27-13-5-7-15-29(27)33)24-18-16-22(17-19-24)23-9-8-20-30-21-23/h1-21H
InChIKeyJBVQZABRUIWGHU-UHFFFAOYSA-N
MW444.47 g/mol
LogP6.17
Rot. Bonds3

About 10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide

10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide (PubChem CID 140898941) has the molecular formula C29H21N2OP and a molecular weight of 444.47 g/mol. Its IUPAC name is 10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide.

Molecular Properties

Compound Name10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide
PubChem CID140898941
Molecular FormulaC29H21N2OP
Molecular Weight444.47 g/mol
Exact Mass444.14
IUPAC Name10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide
SMILESO=P1(c2ccccc2)c2ccccc2N(c2ccc(-c3cccnc3)cc2)c2ccccc21
InChIInChI=1S/C29H21N2OP/c32-33(25-10-2-1-3-11-25)28-14-6-4-12-26(28)31(27-13-5-7-15-29(27)33)24-18-16-22(17-19-24)23-9-8-20-30-21-23/h1-21H
InChIKeyJBVQZABRUIWGHU-UHFFFAOYSA-N
XLogP6.17
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500444.47
LogP ≤ 56.17
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-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-10-phenylphenophosphazinine 10-oxide;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-10-phenylphenophosphazinine 10-oxide;5-[4-(3,5-dipyridin-3-ylphenyl)phenyl]-10-phenylphenophosphazinine 10-oxide;10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide;10-phenyl-5-(4-pyridin-4-ylphenyl)phenophosphazinine 10-oxide
CID 157082217
10-phenyl-5-(4-pyrido[3,4-b]indol-9-ylphenyl)phenophosphazinine 10-oxide
CID 130260325
5-[3-[3,5-bis(pyrido[4,3-b]indol-5-yl)phenyl]phenyl]-10-phenylphenophosphazinine 10-oxide
CID 130260300
5-[3-[3,5-bis(pyrido[3,4-b]indol-9-yl)phenyl]phenyl]-10-phenylphenophosphazinine 10-oxide
CID 130260294
2,8-di(carbazol-9-yl)-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-10-phenylphenophosphazinine 10-oxide;10-(3,5-diphenylphenyl)-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenophosphazinine 10-oxide;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-dimethylfluoren-2-yl]-10-phenylphenophosphazinine 10-oxide;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-10-(3-pyridin-3-ylphenyl)phenophosphazinine 10-oxide;10-phenyl-5-(3-pyridin-3-ylphenyl)phenophosphazinine 10-oxide
CID 159948253
5-[3,5-bis(pyrido[3,4-b]indol-9-yl)phenyl]-10-phenylphenophosphazinine 10-oxide
CID 130260596
10-phenyl-2-(6-pyridin-3-yl-2-pyridinyl)phenoxaphosphinine 10-oxide
CID 130355946
3-bromo-5,10-diphenylphenophosphazinine 10-oxide
CID 140919766
10-phenyl-2-(10-pyridin-3-ylanthracen-9-yl)phenoxaphosphinine 10-oxide
CID 130355985
10',14-diphenyl-3'-(3-phenyl-5-pyridin-3-ylphenyl)spiro[10-oxa-14λ5-phosphapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,9'-acridine] 14-oxide;10',14-diphenyl-3'-(3-phenyl-5-pyridin-4-ylphenyl)spiro[10-oxa-14λ5-phosphapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,9'-acridine] 14-oxide;3'-(3-methylphenyl)-10',14-diphenylspiro[10-oxa-14λ5-phosphapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,9'-acridine] 14-oxide;3'-(4-methylphenyl)-10',14-diphenylspiro[10-oxa-14λ5-phosphapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,9'-acridine] 14-oxide
CID 165095573
3-azulen-6-ylpyridine
CID 86232079
5-[3-[3,5-bis(pyrido[2,3-b]indol-9-yl)phenyl]phenyl]-10-phenylphenophosphazinine 10-oxide;5-[3,5-di(carbazol-9-yl)phenyl]-10-phenylphenophosphazinine 10-oxide;5-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]-10-phenylphenophosphazinine 10-oxide;10-phenyl-5-(3-pyrido[4,3-b]indol-5-ylphenyl)phenophosphazinine 10-oxide
CID 158918939

Frequently Asked Questions

What is the IUPAC name of 10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide?
The IUPAC name of 10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide (CID 140898941) is 10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide.
What is the SMILES notation for 10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide?
The canonical SMILES for 10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide is O=P1(c2ccccc2)c2ccccc2N(c2ccc(-c3cccnc3)cc2)c2ccccc21.
What is the InChIKey of 10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide?
The InChIKey is JBVQZABRUIWGHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H21N2OP/c32-33(25-10-2-1-3-11-25)28-14-6-4-12-26(28)31(27-13-5-7-15-29(27)33)24-18-16-22(17-19-24)23-9-8-20-30-21-23/h1-21H.
What are the key properties of 10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide?
10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide has a molecular weight of 444.47 g/mol, XLogP of 6.17, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-phenyl-5-(4-pyridin-3-ylphenyl)phenophosphazinine 10-oxide is sourced from PubChem (CID 140898941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).