(4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane

C35H24NPSe — CID 164986129

IUPAC(4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane
SMILES[Se]=P(c1ccccc1)(c1ccc(-c2ccc3ccc4ccccc4c3n2)cc1)c1ccc2ccccc2c1
InChIInChI=1S/C35H24NPSe/c38-37(30-11-2-1-3-12-30,32-22-16-25-8-4-5-10-29(25)24-32)31-20-17-27(18-21-31)34-23-19-28-15-14-26-9-6-7-13-33(26)35(28)36-34/h1-24H
InChIKeySZMOPXPOGVZOBV-UHFFFAOYSA-N
MW568.52 g/mol
LogP7.59
Rot. Bonds4

About (4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane

(4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane (PubChem CID 164986129) has the molecular formula C35H24NPSe and a molecular weight of 568.52 g/mol. Its IUPAC name is (4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane.

Molecular Properties

Compound Name(4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane
PubChem CID164986129
Molecular FormulaC35H24NPSe
Molecular Weight568.52 g/mol
Exact Mass569.08
IUPAC Name(4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane
SMILES[Se]=P(c1ccccc1)(c1ccc(-c2ccc3ccc4ccccc4c3n2)cc1)c1ccc2ccccc2c1
InChIInChI=1S/C35H24NPSe/c38-37(30-11-2-1-3-12-30,32-22-16-25-8-4-5-10-29(25)24-32)31-20-17-27(18-21-31)34-23-19-28-15-14-26-9-6-7-13-33(26)35(28)36-34/h1-24H
InChIKeySZMOPXPOGVZOBV-UHFFFAOYSA-N
XLogP7.59
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500568.52
LogP ≤ 57.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze (4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4-benzo[h]quinolin-2-ylphenyl)-diphenyl-selanylidene-λ5-phosphane
CID 165070719
9-naphthalen-2-yl-2-[4-(9-naphthalen-2-ylbenzo[h]quinolin-2-yl)phenyl]benzo[h]quinoline
CID 59010374
2-(4-diphenylphosphorylphenyl)-9-naphthalen-2-yl-1,10-phenanthroline
CID 134470905
naphthalen-2-yl-(4-naphtho[1,2-h]quinolin-12-ylphenyl)-phenyl-selanylidene-λ5-phosphane
CID 165025890
iridium;2-phenylbenzo[h]quinoline
CID 175438986
2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]benzo[h]quinoline
CID 129265511
2-[7-(2-naphthalen-2-ylquinolin-7-yl)quinolin-2-yl]benzo[h]quinoline
CID 155022869
CID 89063916
CID 89063916
2-(3-benzo[h]quinolin-2-ylphenyl)benzo[h]quinoline
CID 10741400
2-naphthalen-2-yl-9-[4-(9-naphthalen-2-yl-1,10-phenanthrolin-2-yl)naphthalen-1-yl]-1,10-phenanthroline
CID 59010533
(4-acridin-9-ylphenyl)-diphenyl-selanylidene-λ5-phosphane;(4-benzo[h]quinolin-2-ylphenyl)-diphenyl-selanylidene-λ5-phosphane;(4-benzo[h]quinolin-5-ylphenyl)-diphenyl-selanylidene-λ5-phosphane;(4-naphtho[2,1-g]quinolin-7-ylphenyl)-diphenyl-selanylidene-λ5-phosphane;(4-naphtho[1,2-h]quinolin-12-ylphenyl)-diphenyl-selanylidene-λ5-phosphane;(4-naphtho[2,1-h]quinolin-6-ylphenyl)-diphenyl-selanylidene-λ5-phosphane
CID 165070716
11-[7-(3-benzo[h]quinolin-2-yl-10-naphthalen-2-ylanthracen-9-yl)naphthalen-2-yl]-6-phenylpyrido[2,3-f][4,7]phenanthroline
CID 139407490

Frequently Asked Questions

What is the IUPAC name of (4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane?
The IUPAC name of (4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane (CID 164986129) is (4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane.
What is the SMILES notation for (4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane?
The canonical SMILES for (4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane is [Se]=P(c1ccccc1)(c1ccc(-c2ccc3ccc4ccccc4c3n2)cc1)c1ccc2ccccc2c1.
What is the InChIKey of (4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane?
The InChIKey is SZMOPXPOGVZOBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H24NPSe/c38-37(30-11-2-1-3-12-30,32-22-16-25-8-4-5-10-29(25)24-32)31-20-17-27(18-21-31)34-23-19-28-15-14-26-9-6-7-13-33(26)35(28)36-34/h1-24H.
What are the key properties of (4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane?
(4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane has a molecular weight of 568.52 g/mol, XLogP of 7.59, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-benzo[h]quinolin-2-ylphenyl)-naphthalen-2-yl-phenyl-selanylidene-λ5-phosphane is sourced from PubChem (CID 164986129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).