5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine

C78H52N18O2 — CID 161154153

IUPAC5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine
SMILESc1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc(-c2nccnc2-c2ccccn2)nc1.c1ccc(-c2nnc(-c3ccco3)c(-c3ccco3)n2)nc1.c1cnc(-c2cncnc2)nc1.c1cnc2nc(-c3ccc4cccnc4n3)ccc2c1
InChIInChI=1S/C24H16N2.C16H10N4O2.C16H10N4.C14H10N4.C8H6N4/c1-3-7-17(8-4-1)19-13-15-25-23-21(19)11-12-22-20(14-16-26-24(22)23)18-9-5-2-6-10-18;1-2-8-17-11(5-1)16-18-14(12-6-3-9-21-12)15(19-20-16)13-7-4-10-22-13;1-3-11-5-7-13(19-15(11)17-9-1)14-8-6-12-4-2-10-18-16(12)20-14;1-3-7-15-11(5-1)13-14(18-10-9-17-13)12-6-2-4-8-16-12;1-2-11-8(12-3-1)7-4-9-6-10-5-7/h1-16H;1-10H;1-10H;1-10H;1-6H
InChIKeyUPBOAGUZYMIDTL-UHFFFAOYSA-N
MW1273.40 g/mol
LogP16.34
Rot. Bonds9

About 5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine

5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine (PubChem CID 161154153) has the molecular formula C78H52N18O2 and a molecular weight of 1273.40 g/mol. Its IUPAC name is 5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine.

Molecular Properties

Compound Name5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine
PubChem CID161154153
Molecular FormulaC78H52N18O2
Molecular Weight1273.40 g/mol
Exact Mass1272.45
IUPAC Name5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine
SMILESc1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc(-c2nccnc2-c2ccccn2)nc1.c1ccc(-c2nnc(-c3ccco3)c(-c3ccco3)n2)nc1.c1cnc(-c2cncnc2)nc1.c1cnc2nc(-c3ccc4cccnc4n3)ccc2c1
InChIInChI=1S/C24H16N2.C16H10N4O2.C16H10N4.C14H10N4.C8H6N4/c1-3-7-17(8-4-1)19-13-15-25-23-21(19)11-12-22-20(14-16-26-24(22)23)18-9-5-2-6-10-18;1-2-8-17-11(5-1)16-18-14(12-6-3-9-21-12)15(19-20-16)13-7-4-10-22-13;1-3-11-5-7-13(19-15(11)17-9-1)14-8-6-12-4-2-10-18-16(12)20-14;1-3-7-15-11(5-1)13-14(18-10-9-17-13)12-6-2-4-8-16-12;1-2-11-8(12-3-1)7-4-9-6-10-5-7/h1-16H;1-10H;1-10H;1-10H;1-6H
InChIKeyUPBOAGUZYMIDTL-UHFFFAOYSA-N
XLogP16.34
TPSA258.30 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds9
Heavy Atoms98
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001273.40
LogP ≤ 516.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze 5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine?
The IUPAC name of 5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine (CID 161154153) is 5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine.
What is the SMILES notation for 5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine?
The canonical SMILES for 5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine is c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc(-c2nccnc2-c2ccccn2)nc1.c1ccc(-c2nnc(-c3ccco3)c(-c3ccco3)n2)nc1.c1cnc(-c2cncnc2)nc1.c1cnc2nc(-c3ccc4cccnc4n3)ccc2c1.
What is the InChIKey of 5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine?
The InChIKey is UPBOAGUZYMIDTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N2.C16H10N4O2.C16H10N4.C14H10N4.C8H6N4/c1-3-7-17(8-4-1)19-13-15-25-23-21(19)11-12-22-20(14-16-26-24(22)23)18-9-5-2-6-10-18;1-2-8-17-11(5-1)16-18-14(12-6-3-9-21-12)15(19-20-16)13-7-4-10-22-13;1-3-11-5-7-13(19-15(11)17-9-1)14-8-6-12-4-2-10-18-16(12)20-14;1-3-7-15-11(5-1)13-14(18-10-9-17-13)12-6-2-4-8-16-12;1-2-11-8(12-3-1)7-4-9-6-10-5-7/h1-16H;1-10H;1-10H;1-10H;1-6H.
What are the key properties of 5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine?
5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine has a molecular weight of 1273.40 g/mol, XLogP of 16.34, 9 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-bis(furan-2-yl)-3-pyridin-2-yl-1,2,4-triazine;4,7-diphenyl-1,10-phenanthroline;2,3-dipyridin-2-ylpyrazine;2-(1,8-naphthyridin-2-yl)-1,8-naphthyridine;2-pyrimidin-5-ylpyrimidine is sourced from PubChem (CID 161154153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).