2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide

C24H23N5O5S — CID 23551869

IUPAC2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide
SMILESCc1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)c(=O)n1CC(=O)NCc1ccc2cn[nH]c2c1
InChIInChI=1S/C24H23N5O5S/c1-15-2-6-20(28-35(32,33)19-5-7-22-17(11-19)8-9-34-22)24(31)29(15)14-23(30)25-12-16-3-4-18-13-26-27-21(18)10-16/h2-7,10-11,13,28H,8-9,12,14H2,1H3,(H,25,30)(H,26,27)
InChIKeyOOEDYDVJKMTCKN-UHFFFAOYSA-N
MW493.55 g/mol
LogP2.09
Rot. Bonds7

About 2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide

2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide (PubChem CID 23551869) has the molecular formula C24H23N5O5S and a molecular weight of 493.55 g/mol. Its IUPAC name is 2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide
PubChem CID23551869
Molecular FormulaC24H23N5O5S
Molecular Weight493.55 g/mol
Exact Mass493.14
IUPAC Name2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide
SMILESCc1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)c(=O)n1CC(=O)NCc1ccc2cn[nH]c2c1
InChIInChI=1S/C24H23N5O5S/c1-15-2-6-20(28-35(32,33)19-5-7-22-17(11-19)8-9-34-22)24(31)29(15)14-23(30)25-12-16-3-4-18-13-26-27-21(18)10-16/h2-7,10-11,13,28H,8-9,12,14H2,1H3,(H,25,30)(H,26,27)
InChIKeyOOEDYDVJKMTCKN-UHFFFAOYSA-N
XLogP2.09
TPSA135.18 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500493.55
LogP ≤ 52.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide 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 2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide?
The IUPAC name of 2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide (CID 23551869) is 2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide.
What is the SMILES notation for 2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide?
The canonical SMILES for 2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide is Cc1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)c(=O)n1CC(=O)NCc1ccc2cn[nH]c2c1.
What is the InChIKey of 2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide?
The InChIKey is OOEDYDVJKMTCKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5O5S/c1-15-2-6-20(28-35(32,33)19-5-7-22-17(11-19)8-9-34-22)24(31)29(15)14-23(30)25-12-16-3-4-18-13-26-27-21(18)10-16/h2-7,10-11,13,28H,8-9,12,14H2,1H3,(H,25,30)(H,26,27).
What are the key properties of 2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide?
2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide has a molecular weight of 493.55 g/mol, XLogP of 2.09, 7 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]-N-(1H-indazol-6-ylmethyl)acetamide is sourced from PubChem (CID 23551869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).