3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide

C19H19N3O3S2 — CID 27167522

IUPAC3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
SMILESCCNS(=O)(=O)c1cccc(C(=O)Nc2ccc(-c3csc(C)n3)cc2)c1
InChIInChI=1S/C19H19N3O3S2/c1-3-20-27(24,25)17-6-4-5-15(11-17)19(23)22-16-9-7-14(8-10-16)18-12-26-13(2)21-18/h4-12,20H,3H2,1-2H3,(H,22,23)
InChIKeyUOQKBSFCBCGSJV-UHFFFAOYSA-N
MW401.51 g/mol
LogP3.67
Rot. Bonds6

About 3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide

3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide (PubChem CID 27167522) has the molecular formula C19H19N3O3S2 and a molecular weight of 401.51 g/mol. Its IUPAC name is 3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide.

Molecular Properties

Compound Name3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
PubChem CID27167522
Molecular FormulaC19H19N3O3S2
Molecular Weight401.51 g/mol
Exact Mass401.09
IUPAC Name3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
SMILESCCNS(=O)(=O)c1cccc(C(=O)Nc2ccc(-c3csc(C)n3)cc2)c1
InChIInChI=1S/C19H19N3O3S2/c1-3-20-27(24,25)17-6-4-5-15(11-17)19(23)22-16-9-7-14(8-10-16)18-12-26-13(2)21-18/h4-12,20H,3H2,1-2H3,(H,22,23)
InChIKeyUOQKBSFCBCGSJV-UHFFFAOYSA-N
XLogP3.67
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.51
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(ethylsulfamoyl)-2-methyl-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 27167610
3-[methoxy(methyl)sulfamoyl]-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 8534346
3-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]sulfamoyl]benzoic acid
CID 8841398
3-methoxy-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 737892
3-(ethylsulfamoyl)-N-(4-methylsulfanylphenyl)benzamide
CID 27365149
3-(2-methylpropoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 108727275
3-(ethylsulfamoyl)-N-(3-iodophenyl)benzamide
CID 31528390
N-(4-methylphenyl)-3-(2-methylpropylsulfamoyl)benzamide
CID 109062704
4-acetamido-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 27167057
N-(2-acetamido-1,3-benzothiazol-6-yl)-3-(ethylsulfamoyl)benzamide
CID 55768437
N-[4-[2-[(3-acetylphenyl)sulfonylamino]-1,3-thiazol-4-yl]phenyl]acetamide
CID 8504634
4-iodo-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 27167049

Frequently Asked Questions

What is the IUPAC name of 3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide?
The IUPAC name of 3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide (CID 27167522) is 3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide.
What is the SMILES notation for 3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide?
The canonical SMILES for 3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide is CCNS(=O)(=O)c1cccc(C(=O)Nc2ccc(-c3csc(C)n3)cc2)c1.
What is the InChIKey of 3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide?
The InChIKey is UOQKBSFCBCGSJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3S2/c1-3-20-27(24,25)17-6-4-5-15(11-17)19(23)22-16-9-7-14(8-10-16)18-12-26-13(2)21-18/h4-12,20H,3H2,1-2H3,(H,22,23).
What are the key properties of 3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide?
3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide has a molecular weight of 401.51 g/mol, XLogP of 3.67, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylsulfamoyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide is sourced from PubChem (CID 27167522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).