N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide

C24H18N8OS — CID 71267356

About N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide

N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide (PubChem CID 71267356) has the molecular formula C24H18N8OS and a molecular weight of 466.53 g/mol. Its IUPAC name is N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide.

Molecular Properties

• Compound Name: N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide
• PubChem CID: 71267356
• Molecular Formula: C24H18N8OS
• Molecular Weight: 466.53 g/mol
• Exact Mass: 466.13
• IUPAC Name: N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide
• SMILES: O=C(Nc1cnn(Cc2csc(-c3ccccc3)n2)c1)c1n[nH]c2cc(-c3cn[nH]c3)ccc12
• InChI: InChI=1S/C24H18N8OS/c33-23(22-20-7-6-16(8-21(20)30-31-22)17-9-25-26-10-17)28-18-11-27-32(12-18)13-19-14-34-24(29-19)15-4-2-1-3-5-15/h1-12,14H,13H2,(H,25,26)(H,28,33)(H,30,31)
• InChIKey: VEPRTJPDRFWFAA-UHFFFAOYSA-N
• XLogP: 4.57
• TPSA: 117.17 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 7
• Rotatable Bonds: 6
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	466.53
LogP ≤ 5	4.57
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide?

The IUPAC name of N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide (CID 71267356) is N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide.

What is the SMILES notation for N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide?

The canonical SMILES for N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide is O=C(Nc1cnn(Cc2csc(-c3ccccc3)n2)c1)c1n[nH]c2cc(-c3cn[nH]c3)ccc12.

What is the InChIKey of N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide?

The InChIKey is VEPRTJPDRFWFAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N8OS/c33-23(22-20-7-6-16(8-21(20)30-31-22)17-9-25-26-10-17)28-18-11-27-32(12-18)13-19-14-34-24(29-19)15-4-2-1-3-5-15/h1-12,14H,13H2,(H,25,26)(H,28,33)(H,30,31).

What are the key properties of N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide?

N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide has a molecular weight of 466.53 g/mol, XLogP of 4.57, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 71267356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).