2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide

C17H15N5O2S — CID 46964448

IUPAC2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide
SMILESCCc1nc2ccc(NC(=O)COc3ccc4nsnc4c3)cc2[nH]1
InChIInChI=1S/C17H15N5O2S/c1-2-16-19-12-5-3-10(7-14(12)20-16)18-17(23)9-24-11-4-6-13-15(8-11)22-25-21-13/h3-8H,2,9H2,1H3,(H,18,23)(H,19,20)
InChIKeyKFHXLQVGKFHBQW-UHFFFAOYSA-N
MW353.41 g/mol
LogP3.15
Rot. Bonds5

About 2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide

2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide (PubChem CID 46964448) has the molecular formula C17H15N5O2S and a molecular weight of 353.41 g/mol. Its IUPAC name is 2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide
PubChem CID46964448
Molecular FormulaC17H15N5O2S
Molecular Weight353.41 g/mol
Exact Mass353.09
IUPAC Name2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide
SMILESCCc1nc2ccc(NC(=O)COc3ccc4nsnc4c3)cc2[nH]1
InChIInChI=1S/C17H15N5O2S/c1-2-16-19-12-5-3-10(7-14(12)20-16)18-17(23)9-24-11-4-6-13-15(8-11)22-25-21-13/h3-8H,2,9H2,1H3,(H,18,23)(H,19,20)
InChIKeyKFHXLQVGKFHBQW-UHFFFAOYSA-N
XLogP3.15
TPSA92.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.41
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide with MolForge

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

Launch Full Analysis

Related Compounds

2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-1-methylbenzimidazol-5-yl)acetamide
CID 16672899
N-(2-ethyl-3H-benzimidazol-5-yl)-3-(methylamino)propanamide
CID 96675307
N-(3,4-dimethoxyphenyl)-2-(2-ethyl-3H-benzimidazol-5-yl)acetamide
CID 110772778
2-(1,3-dioxoisoindol-2-yl)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide
CID 110778994
N-(2-ethyl-3H-benzimidazol-5-yl)-2-(1H-indol-3-yl)acetamide
CID 110793188
N-(2-ethyl-3H-benzimidazol-5-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
CID 46964446
2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide
CID 110772765
2-[(1,6-dimethyl-4-oxo-3-pyridinyl)oxy]-N-[2-(hydroxymethyl)-3H-benzimidazol-5-yl]acetamide
CID 125431781
N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide
CID 84581757
N-(3H-benzimidazol-5-yl)-2-(4-methylphenoxy)acetamide
CID 110724326
4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide
CID 110772780
N-(3-acetylphenyl)-2-(2-ethyl-3H-benzimidazol-5-yl)acetamide
CID 110772781

Frequently Asked Questions

What is the IUPAC name of 2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide?
The IUPAC name of 2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide (CID 46964448) is 2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide.
What is the SMILES notation for 2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide?
The canonical SMILES for 2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide is CCc1nc2ccc(NC(=O)COc3ccc4nsnc4c3)cc2[nH]1.
What is the InChIKey of 2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide?
The InChIKey is KFHXLQVGKFHBQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O2S/c1-2-16-19-12-5-3-10(7-14(12)20-16)18-17(23)9-24-11-4-6-13-15(8-11)22-25-21-13/h3-8H,2,9H2,1H3,(H,18,23)(H,19,20).
What are the key properties of 2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide?
2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide has a molecular weight of 353.41 g/mol, XLogP of 3.15, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,1,3-benzothiadiazol-5-yloxy)-N-(2-ethyl-3H-benzimidazol-5-yl)acetamide is sourced from PubChem (CID 46964448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).