N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide

C23H20N4O3S2 — CID 16562803

IUPACN-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
SMILESCN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)Cc2csc(-c3ccccn3)n2)c1
InChIInChI=1S/C23H20N4O3S2/c1-27(19-9-3-2-4-10-19)32(29,30)20-11-7-8-17(14-20)25-22(28)15-18-16-31-23(26-18)21-12-5-6-13-24-21/h2-14,16H,15H2,1H3,(H,25,28)
InChIKeyBXVSEUHWFVQYMW-UHFFFAOYSA-N
MW464.57 g/mol
LogP4.21
Rot. Bonds7

About N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide

N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide (PubChem CID 16562803) has the molecular formula C23H20N4O3S2 and a molecular weight of 464.57 g/mol. Its IUPAC name is N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
PubChem CID16562803
Molecular FormulaC23H20N4O3S2
Molecular Weight464.57 g/mol
Exact Mass464.10
IUPAC NameN-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
SMILESCN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)Cc2csc(-c3ccccn3)n2)c1
InChIInChI=1S/C23H20N4O3S2/c1-27(19-9-3-2-4-10-19)32(29,30)20-11-7-8-17(14-20)25-22(28)15-18-16-31-23(26-18)21-12-5-6-13-24-21/h2-14,16H,15H2,1H3,(H,25,28)
InChIKeyBXVSEUHWFVQYMW-UHFFFAOYSA-N
XLogP4.21
TPSA92.26 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.57
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide
CID 25436690
N-(3-acetylphenyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 34829771
N-[3-(methoxymethyl)phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 32638534
N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 25477825
N-(3-chloro-4-methylphenyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 30424894
N-[3-(dimethylsulfamoyl)phenyl]-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
CID 9255503
4-[[2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetyl]amino]benzamide
CID 26721108
N-[4-methyl-3-(trifluoromethyl)phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 16579285
2-[2-(3-chlorophenyl)-1,3-thiazol-4-yl]-N-[3-(diethylsulfamoyl)phenyl]acetamide
CID 16560776
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 27667849
2-(2-pyridin-2-yl-1,3-thiazol-4-yl)-N-(4-pyrimidin-2-yloxyphenyl)acetamide
CID 55919837
N-propan-2-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 27648148

Frequently Asked Questions

What is the IUPAC name of N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide (CID 16562803) is N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide is CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)Cc2csc(-c3ccccn3)n2)c1.
What is the InChIKey of N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide?
The InChIKey is BXVSEUHWFVQYMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O3S2/c1-27(19-9-3-2-4-10-19)32(29,30)20-11-7-8-17(14-20)25-22(28)15-18-16-31-23(26-18)21-12-5-6-13-24-21/h2-14,16H,15H2,1H3,(H,25,28).
What are the key properties of N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide?
N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide has a molecular weight of 464.57 g/mol, XLogP of 4.21, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 16562803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).