N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide

C23H18N6O — CID 25164676

IUPACN-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide
SMILESO=C(Nc1n[nH]c2ccc(-c3cn(Cc4ccccc4)nn3)cc12)c1ccccc1
InChIInChI=1S/C23H18N6O/c30-23(17-9-5-2-6-10-17)24-22-19-13-18(11-12-20(19)25-27-22)21-15-29(28-26-21)14-16-7-3-1-4-8-16/h1-13,15H,14H2,(H2,24,25,27,30)
InChIKeyUDFDIIVNIYWXDM-UHFFFAOYSA-N
MW394.44 g/mol
LogP4.12
Rot. Bonds5

About N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide

N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide (PubChem CID 25164676) has the molecular formula C23H18N6O and a molecular weight of 394.44 g/mol. Its IUPAC name is N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide.

Molecular Properties

Compound NameN-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide
PubChem CID25164676
Molecular FormulaC23H18N6O
Molecular Weight394.44 g/mol
Exact Mass394.15
IUPAC NameN-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide
SMILESO=C(Nc1n[nH]c2ccc(-c3cn(Cc4ccccc4)nn3)cc12)c1ccccc1
InChIInChI=1S/C23H18N6O/c30-23(17-9-5-2-6-10-17)24-22-19-13-18(11-12-20(19)25-27-22)21-15-29(28-26-21)14-16-7-3-1-4-8-16/h1-13,15H,14H2,(H2,24,25,27,30)
InChIKeyUDFDIIVNIYWXDM-UHFFFAOYSA-N
XLogP4.12
TPSA88.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.44
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide 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 N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide?
The IUPAC name of N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide (CID 25164676) is N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide.
What is the SMILES notation for N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide?
The canonical SMILES for N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide is O=C(Nc1n[nH]c2ccc(-c3cn(Cc4ccccc4)nn3)cc12)c1ccccc1.
What is the InChIKey of N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide?
The InChIKey is UDFDIIVNIYWXDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N6O/c30-23(17-9-5-2-6-10-17)24-22-19-13-18(11-12-20(19)25-27-22)21-15-29(28-26-21)14-16-7-3-1-4-8-16/h1-13,15H,14H2,(H2,24,25,27,30).
What are the key properties of N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide?
N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide has a molecular weight of 394.44 g/mol, XLogP of 4.12, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]benzamide is sourced from PubChem (CID 25164676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).