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

C18H17N3O3S2 — CID 8795483

IUPAC3-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccc(-c3nccs3)cc2)c1
InChIInChI=1S/C18H17N3O3S2/c1-21(2)26(23,24)16-5-3-4-14(12-16)17(22)20-15-8-6-13(7-9-15)18-19-10-11-25-18/h3-12H,1-2H3,(H,20,22)
InChIKeyVXQNHBPTXKSIBI-UHFFFAOYSA-N
MW387.49 g/mol
LogP3.31
Rot. Bonds5

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

3-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide (PubChem CID 8795483) has the molecular formula C18H17N3O3S2 and a molecular weight of 387.49 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide
PubChem CID8795483
Molecular FormulaC18H17N3O3S2
Molecular Weight387.49 g/mol
Exact Mass387.07
IUPAC Name3-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccc(-c3nccs3)cc2)c1
InChIInChI=1S/C18H17N3O3S2/c1-21(2)26(23,24)16-5-3-4-14(12-16)17(22)20-15-8-6-13(7-9-15)18-19-10-11-25-18/h3-12H,1-2H3,(H,20,22)
InChIKeyVXQNHBPTXKSIBI-UHFFFAOYSA-N
XLogP3.31
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.49
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide
CID 4030304
3-[(3-chlorophenyl)sulfamoyl]-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide
CID 24648789
3-fluoro-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide
CID 8795595
3-cyano-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide
CID 8795282
N-[4-(dimethylamino)phenyl]-3-(dimethylsulfamoyl)benzamide
CID 110356126
3-(dimethylsulfamoyl)-N-[4-(4-methylphenoxy)phenyl]benzamide
CID 4800647
N-(6-bromo-3-pyridinyl)-3-(dimethylsulfamoyl)benzamide
CID 110614688
3-(oxolan-2-ylmethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide
CID 24648821
methyl 2-[3-[[4-(1,3-thiazol-2-yl)phenyl]carbamoyl]phenoxy]acetate
CID 55875358
N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide
CID 2221562
4-amino-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide
CID 60926943
2-chloro-5-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
CID 55602065

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide (CID 8795483) is 3-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide is CN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccc(-c3nccs3)cc2)c1.
What is the InChIKey of 3-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide?
The InChIKey is VXQNHBPTXKSIBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3S2/c1-21(2)26(23,24)16-5-3-4-14(12-16)17(22)20-15-8-6-13(7-9-15)18-19-10-11-25-18/h3-12H,1-2H3,(H,20,22).
What are the key properties of 3-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide?
3-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide has a molecular weight of 387.49 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide is sourced from PubChem (CID 8795483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).