2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine

C20H12N10 — CID 90934229

IUPAC2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine
SMILESc1cnc(-c2c(-c3cnccn3)cnc(-c3ncncn3)c2-c2cccnn2)nc1
InChIInChI=1S/C20H12N10/c1-3-14(30-29-6-1)17-16(19-24-4-2-5-25-19)13(15-10-21-7-8-23-15)9-26-18(17)20-27-11-22-12-28-20/h1-12H
InChIKeyXTAZSXMUHZRKJW-UHFFFAOYSA-N
MW392.39 g/mol
LogP2.30
Rot. Bonds4

About 2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine

2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine (PubChem CID 90934229) has the molecular formula C20H12N10 and a molecular weight of 392.39 g/mol. Its IUPAC name is 2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine
PubChem CID90934229
Molecular FormulaC20H12N10
Molecular Weight392.39 g/mol
Exact Mass392.12
IUPAC Name2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine
SMILESc1cnc(-c2c(-c3cnccn3)cnc(-c3ncncn3)c2-c2cccnn2)nc1
InChIInChI=1S/C20H12N10/c1-3-14(30-29-6-1)17-16(19-24-4-2-5-25-19)13(15-10-21-7-8-23-15)9-26-18(17)20-27-11-22-12-28-20/h1-12H
InChIKeyXTAZSXMUHZRKJW-UHFFFAOYSA-N
XLogP2.30
TPSA128.90 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.39
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine with MolForge

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Related Compounds

3-(2-Pyridyl)-5,6-diphenyl-1,2,4-triazine
CID 70588
Tt-301
CID 54576073
2-{3-Phenylpyrazolo[1,5-a]pyrimidin-6-yl}pyridine
CID 5329461
3-Phenyl-4-(Pyridin-4-Yl)-6-[4-(Pyrimidin-2-Yl)piperazin-1-Yl]pyridazine
CID 24743826
1-Phenyl-4-[4-[phenyl(2-pyridyl)methyl]piperazin-1-yl]pyrazolo[3,4-d]pyrimidine
CID 3011482
3,5,6-Tri(pyridin-2-yl)-1,2,4-triazine
CID 473557
2,4-Bis(5,6-diphenyl-1,2,4-triazine-3-yl)pyridine
CID 118779
Minozac free base
CID 11515480
6-Phenyl-N-(Pyridin-4-Yl)pyrrolo[2,1-F][1,2,4]triazin-4-Amine
CID 77068235
4-(1-ethyl-3-pyridin-3-yl-pyrazol-4-yl)-~{N}-(4-piperazin-1-ylphenyl)pyrimidin-2-amine
CID 142395406
N-benzyl-6-phenyl-3-(2-pyridinyl)-1,2,4-triazin-5-amine
CID 6404644
5,6-Diphenyl-3-pyridin-4-yl-1,2,4-triazine
CID 6409328

Frequently Asked Questions

What is the IUPAC name of 2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine?
The IUPAC name of 2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine (CID 90934229) is 2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine.
What is the SMILES notation for 2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine?
The canonical SMILES for 2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine is c1cnc(-c2c(-c3cnccn3)cnc(-c3ncncn3)c2-c2cccnn2)nc1.
What is the InChIKey of 2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine?
The InChIKey is XTAZSXMUHZRKJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12N10/c1-3-14(30-29-6-1)17-16(19-24-4-2-5-25-19)13(15-10-21-7-8-23-15)9-26-18(17)20-27-11-22-12-28-20/h1-12H.
What are the key properties of 2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine?
2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine has a molecular weight of 392.39 g/mol, XLogP of 2.30, 4 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-pyrazin-2-yl-3-pyridazin-3-yl-4-pyrimidin-2-yl-2-pyridinyl)-1,3,5-triazine is sourced from PubChem (CID 90934229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).