2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide

C13H14ClN3O3S2 — CID 2660393

IUPAC2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1cnc(NC(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)s1
InChIInChI=1S/C13H14ClN3O3S2/c1-8-7-15-13(21-8)16-12(18)10-6-9(4-5-11(10)14)22(19,20)17(2)3/h4-7H,1-3H3,(H,15,16,18)
InChIKeyLVXLVVPEMFFYLJ-UHFFFAOYSA-N
MW359.86 g/mol
LogP2.61
Rot. Bonds4

About 2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide

2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 2660393) has the molecular formula C13H14ClN3O3S2 and a molecular weight of 359.86 g/mol. Its IUPAC name is 2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID2660393
Molecular FormulaC13H14ClN3O3S2
Molecular Weight359.86 g/mol
Exact Mass359.02
IUPAC Name2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1cnc(NC(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)s1
InChIInChI=1S/C13H14ClN3O3S2/c1-8-7-15-13(21-8)16-12(18)10-6-9(4-5-11(10)14)22(19,20)17(2)3/h4-7H,1-3H3,(H,15,16,18)
InChIKeyLVXLVVPEMFFYLJ-UHFFFAOYSA-N
XLogP2.61
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.86
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(4-chlorophenyl)sulfonylamino]-N-(1,3-thiazol-2-yl)benzamide
CID 1336667
2-(2-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
CID 2673027
2-chloro-5-(morpholin-4-ylsulfonyl)-N-(1,3-thiazol-2-yl)benzamide
CID 1102161
2-chloro-5-methylsulfanyl-N-(1,3-thiazol-2-yl)benzamide
CID 676855
N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 2673074
N-(5-(2-chlorobenzyl)thiazol-2-yl)thiophene-2-carboxamide
CID 2447649
2-chloro-5-(dimethylsulfamoyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 2660568
4-chloro-3-(1-piperidinylsulfonyl)-N-(2-thiazolyl)benzamide
CID 1101757
2-chloro-N-[3-[(5-methyl-1,3-thiazol-2-yl)amino]-3-oxopropyl]benzamide
CID 2490376
N-(5-methyl-1,3-thiazol-2-yl)-3-morpholin-4-ylsulfonylbenzamide
CID 3616684
4-chloro-N-[4-[(5-methyl-1,3-thiazol-2-yl)amino]-4-oxobutyl]benzamide
CID 4826625
2-chloro-5-(piperidin-1-ylsulfonyl)-N-(1,3-thiazol-2-yl)benzamide
CID 1102162

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide (CID 2660393) is 2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide is Cc1cnc(NC(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)s1.
What is the InChIKey of 2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is LVXLVVPEMFFYLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClN3O3S2/c1-8-7-15-13(21-8)16-12(18)10-6-9(4-5-11(10)14)22(19,20)17(2)3/h4-7H,1-3H3,(H,15,16,18).
What are the key properties of 2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 359.86 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 2660393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).