(2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide

C22H20N4O4S — CID 53476758

IUPAC(2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide
SMILESCO[C@@H](C(=O)Nc1ccc2[nH]nc(-c3cccc(S(N)(=O)=O)c3)c2c1)c1ccccc1
InChIInChI=1S/C22H20N4O4S/c1-30-21(14-6-3-2-4-7-14)22(27)24-16-10-11-19-18(13-16)20(26-25-19)15-8-5-9-17(12-15)31(23,28)29/h2-13,21H,1H3,(H,24,27)(H,25,26)(H2,23,28,29)/t21-/m1/s1
InChIKeyWBKWIGZIJLEGEF-OAQYLSRUSA-N
MW436.49 g/mol
LogP3.20
Rot. Bonds6

About (2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide

(2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide (PubChem CID 53476758) has the molecular formula C22H20N4O4S and a molecular weight of 436.49 g/mol. Its IUPAC name is (2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide.

Molecular Properties

Compound Name(2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide
PubChem CID53476758
Molecular FormulaC22H20N4O4S
Molecular Weight436.49 g/mol
Exact Mass436.12
IUPAC Name(2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide
SMILESCO[C@@H](C(=O)Nc1ccc2[nH]nc(-c3cccc(S(N)(=O)=O)c3)c2c1)c1ccccc1
InChIInChI=1S/C22H20N4O4S/c1-30-21(14-6-3-2-4-7-14)22(27)24-16-10-11-19-18(13-16)20(26-25-19)15-8-5-9-17(12-15)31(23,28)29/h2-13,21H,1H3,(H,24,27)(H,25,26)(H2,23,28,29)/t21-/m1/s1
InChIKeyWBKWIGZIJLEGEF-OAQYLSRUSA-N
XLogP3.20
TPSA127.17 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.49
LogP ≤ 53.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze (2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-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

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide?
The IUPAC name of (2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide (CID 53476758) is (2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide.
What is the SMILES notation for (2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide?
The canonical SMILES for (2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide is CO[C@@H](C(=O)Nc1ccc2[nH]nc(-c3cccc(S(N)(=O)=O)c3)c2c1)c1ccccc1.
What is the InChIKey of (2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide?
The InChIKey is WBKWIGZIJLEGEF-OAQYLSRUSA-N. The full InChI is InChI=1S/C22H20N4O4S/c1-30-21(14-6-3-2-4-7-14)22(27)24-16-10-11-19-18(13-16)20(26-25-19)15-8-5-9-17(12-15)31(23,28)29/h2-13,21H,1H3,(H,24,27)(H,25,26)(H2,23,28,29)/t21-/m1/s1.
What are the key properties of (2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide?
(2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide has a molecular weight of 436.49 g/mol, XLogP of 3.20, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methoxy-2-phenyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide is sourced from PubChem (CID 53476758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).