6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine

C36H23N3 — CID 160823432

IUPAC6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5nc6ccccc6c6ccccc56)cc43)c2)nc1
InChIInChI=1S/C36H23N3/c1-2-15-31-27(12-1)28-13-3-5-17-33(28)38-36(31)25-19-20-30-29-14-4-6-18-34(29)39(35(30)23-25)26-11-9-10-24(22-26)32-16-7-8-21-37-32/h1-23H
InChIKeyGDIZKSJMLRTXDD-UHFFFAOYSA-N
MW497.60 g/mol
LogP9.21
Rot. Bonds3

About 6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine

6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine (PubChem CID 160823432) has the molecular formula C36H23N3 and a molecular weight of 497.60 g/mol. Its IUPAC name is 6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine.

Molecular Properties

Compound Name6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine
PubChem CID160823432
Molecular FormulaC36H23N3
Molecular Weight497.60 g/mol
Exact Mass497.19
IUPAC Name6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5nc6ccccc6c6ccccc56)cc43)c2)nc1
InChIInChI=1S/C36H23N3/c1-2-15-31-27(12-1)28-13-3-5-17-33(28)38-36(31)25-19-20-30-29-14-4-6-18-34(29)39(35(30)23-25)26-11-9-10-24(22-26)32-16-7-8-21-37-32/h1-23H
InChIKeyGDIZKSJMLRTXDD-UHFFFAOYSA-N
XLogP9.21
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500497.60
LogP ≤ 59.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[4-(4-phenylphenyl)-2-pyridinyl]-9-(3-pyridin-2-ylphenyl)carbazole
CID 140825608
2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole
CID 153285337
7-pyridin-2-yl-2-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]-1,3-benzothiazole
CID 142329340
7-pyridin-2-yl-2-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]-1,3-benzoxazole
CID 153285686
2-(3-carbazol-9-ylphenyl)-9-[3-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]carbazole
CID 134252122
20-(3-pyridin-2-ylphenyl)-2,9,20-triazaheptacyclo[15.11.0.02,10.03,8.011,16.019,27.021,26]octacosa-1(28),3,5,7,9,11,13,15,17,19(27),21,23,25-tridecaene
CID 90432578
7-[9-[3-(3,5-dipyridin-2-ylphenyl)phenyl]carbazol-3-yl]-5-phenylpyrido[3,2-b]indole
CID 129221946
2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylphenyl)carbazol-2-yl]-1,3-benzothiazole
CID 153285040
2-[9-[3-(3-pyridin-2-yl-2-pyridinyl)phenyl]carbazol-2-yl]-1,3-benzothiazole
CID 142329469
5-carbazol-9-yl-2-[3-(2-pyridin-2-ylcarbazol-9-yl)phenyl]-1,3-oxazole
CID 140730755
2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-6-pyridin-2-yl-9-(3-pyridin-2-ylphenyl)carbazole
CID 153285580
9-phenyl-3-[3-[3-(3-pyridin-2-ylphenyl)phenyl]phenyl]carbazole
CID 153423283

Frequently Asked Questions

What is the IUPAC name of 6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine?
The IUPAC name of 6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine (CID 160823432) is 6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine.
What is the SMILES notation for 6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine?
The canonical SMILES for 6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine is c1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5nc6ccccc6c6ccccc56)cc43)c2)nc1.
What is the InChIKey of 6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine?
The InChIKey is GDIZKSJMLRTXDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H23N3/c1-2-15-31-27(12-1)28-13-3-5-17-33(28)38-36(31)25-19-20-30-29-14-4-6-18-34(29)39(35(30)23-25)26-11-9-10-24(22-26)32-16-7-8-21-37-32/h1-23H.
What are the key properties of 6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine?
6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine has a molecular weight of 497.60 g/mol, XLogP of 9.21, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine is sourced from PubChem (CID 160823432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).