3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide

C22H17ClN4O4S — CID 19176544

IUPAC3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide
SMILESCc1onc(-c2ccccc2Cl)c1C(=O)Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1
InChIInChI=1S/C22H17ClN4O4S/c1-14-20(21(26-31-14)17-6-2-3-7-18(17)23)22(28)25-15-9-11-16(12-10-15)32(29,30)27-19-8-4-5-13-24-19/h2-13H,1H3,(H,24,27)(H,25,28)
InChIKeyDFTZWDOUHQXIOA-UHFFFAOYSA-N
MW468.92 g/mol
LogP4.75
Rot. Bonds6

About 3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide

3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide (PubChem CID 19176544) has the molecular formula C22H17ClN4O4S and a molecular weight of 468.92 g/mol. Its IUPAC name is 3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide
PubChem CID19176544
Molecular FormulaC22H17ClN4O4S
Molecular Weight468.92 g/mol
Exact Mass468.07
IUPAC Name3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide
SMILESCc1onc(-c2ccccc2Cl)c1C(=O)Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1
InChIInChI=1S/C22H17ClN4O4S/c1-14-20(21(26-31-14)17-6-2-3-7-18(17)23)22(28)25-15-9-11-16(12-10-15)32(29,30)27-19-8-4-5-13-24-19/h2-13H,1H3,(H,24,27)(H,25,28)
InChIKeyDFTZWDOUHQXIOA-UHFFFAOYSA-N
XLogP4.75
TPSA114.19 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500468.92
LogP ≤ 54.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide 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

3-(2-chlorophenyl)-5-methyl-N-[4-(propan-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide
CID 17147423
3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 1078174
N-[4-(tert-butylsulfamoyl)phenyl]-3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 3384890
3,4-dimethyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 1078179
3-(2-chlorophenyl)-N-(2-hydroxyphenyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 2996672
3-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]benzoic acid
CID 1042639
N-(3-carbamoyl-4-methylphenyl)-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 166186406
3-(2-chlorophenyl)-N-[2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-methylphenyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 3443084
3-(2-chlorophenyl)-5-methyl-N-[4-[(2-methyl-6-pyrrolidin-1-ylpyrimidin-4-yl)amino]phenyl]-1,2-oxazole-4-carboxamide
CID 122297240
3-(2-chlorophenyl)-5-methyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1,2-oxazole-4-carboxamide
CID 17488472
3-(2-chlorophenyl)-5-methyl-N-[4-(morpholin-4-ylmethyl)phenyl]-1,2-oxazole-4-carboxamide
CID 112796045
3-(2-chlorophenyl)-N-[4-(5-methoxy-2-oxo-1,3,4-oxadiazol-3-yl)phenyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 151182618

Frequently Asked Questions

What is the IUPAC name of 3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide?
The IUPAC name of 3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide (CID 19176544) is 3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide?
The canonical SMILES for 3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide is Cc1onc(-c2ccccc2Cl)c1C(=O)Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1.
What is the InChIKey of 3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide?
The InChIKey is DFTZWDOUHQXIOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17ClN4O4S/c1-14-20(21(26-31-14)17-6-2-3-7-18(17)23)22(28)25-15-9-11-16(12-10-15)32(29,30)27-19-8-4-5-13-24-19/h2-13H,1H3,(H,24,27)(H,25,28).
What are the key properties of 3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide?
3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide has a molecular weight of 468.92 g/mol, XLogP of 4.75, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 19176544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).