N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]-5-phenyl-1,2-oxazole-3-carboxamide

C24H18N6O3 — CID 122305201

About N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]-5-phenyl-1,2-oxazole-3-carboxamide

N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]-5-phenyl-1,2-oxazole-3-carboxamide (PubChem CID 122305201) has the molecular formula C24H18N6O3 and a molecular weight of 438.45 g/mol. Its IUPAC name is N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]-5-phenyl-1,2-oxazole-3-carboxamide.

Molecular Properties

• Compound Name: N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]-5-phenyl-1,2-oxazole-3-carboxamide
• PubChem CID: 122305201
• Molecular Formula: C24H18N6O3
• Molecular Weight: 438.45 g/mol
• Exact Mass: 438.14
• IUPAC Name: N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]-5-phenyl-1,2-oxazole-3-carboxamide
• SMILES: Cc1ccn(-c2ccc(Oc3ccc(NC(=O)c4cc(-c5ccccc5)on4)cc3)nn2)n1
• InChI: InChI=1S/C24H18N6O3/c1-16-13-14-30(28-16)22-11-12-23(27-26-22)32-19-9-7-18(8-10-19)25-24(31)20-15-21(33-29-20)17-5-3-2-4-6-17/h2-15H,1H3,(H,25,31)
• InChIKey: LWHSBJLBPOYOOF-UHFFFAOYSA-N
• XLogP: 4.67
• TPSA: 107.96 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 6
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	438.45
LogP ≤ 5	4.67
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]-5-phenyl-1,2-oxazole-3-carboxamide?

The IUPAC name of N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]-5-phenyl-1,2-oxazole-3-carboxamide (CID 122305201) is N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]-5-phenyl-1,2-oxazole-3-carboxamide.

What is the SMILES notation for N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]-5-phenyl-1,2-oxazole-3-carboxamide?

The canonical SMILES for N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]-5-phenyl-1,2-oxazole-3-carboxamide is Cc1ccn(-c2ccc(Oc3ccc(NC(=O)c4cc(-c5ccccc5)on4)cc3)nn2)n1.

What is the InChIKey of N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]-5-phenyl-1,2-oxazole-3-carboxamide?

The InChIKey is LWHSBJLBPOYOOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N6O3/c1-16-13-14-30(28-16)22-11-12-23(27-26-22)32-19-9-7-18(8-10-19)25-24(31)20-15-21(33-29-20)17-5-3-2-4-6-17/h2-15H,1H3,(H,25,31).

What are the key properties of N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]-5-phenyl-1,2-oxazole-3-carboxamide?

N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]-5-phenyl-1,2-oxazole-3-carboxamide has a molecular weight of 438.45 g/mol, XLogP of 4.67, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]-5-phenyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 122305201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).