2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide

C10H5Cl2N3O2S2 — CID 107807707

IUPAC2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide
SMILESN#Cc1ccc(NS(=O)(=O)c2cnc(Cl)s2)c(Cl)c1
InChIInChI=1S/C10H5Cl2N3O2S2/c11-7-3-6(4-13)1-2-8(7)15-19(16,17)9-5-14-10(12)18-9/h1-3,5,15H
InChIKeyVBQZDNVCBQQTOU-UHFFFAOYSA-N
MW334.21 g/mol
LogP3.12
Rot. Bonds3

About 2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide

2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide (PubChem CID 107807707) has the molecular formula C10H5Cl2N3O2S2 and a molecular weight of 334.21 g/mol. Its IUPAC name is 2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide
PubChem CID107807707
Molecular FormulaC10H5Cl2N3O2S2
Molecular Weight334.21 g/mol
Exact Mass332.92
IUPAC Name2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide
SMILESN#Cc1ccc(NS(=O)(=O)c2cnc(Cl)s2)c(Cl)c1
InChIInChI=1S/C10H5Cl2N3O2S2/c11-7-3-6(4-13)1-2-8(7)15-19(16,17)9-5-14-10(12)18-9/h1-3,5,15H
InChIKeyVBQZDNVCBQQTOU-UHFFFAOYSA-N
XLogP3.12
TPSA82.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.21
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-N-(2-chlorophenyl)-1,3-thiazole-5-sulfonamide
CID 43427443
2-amino-N-(2-chloro-4-cyanophenyl)pyrimidine-5-sulfonamide
CID 107810158
N-(2-chloro-4-cyanophenyl)-2-(methylamino)pyrimidine-5-sulfonamide
CID 107810157
2-chloro-N-(2-chloro-5-iodophenyl)-1,3-thiazole-5-sulfonamide
CID 114259497
N-(2-chloro-4-cyanophenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 103791873
N-(2-chloro-4-cyanophenyl)-3-fluoropyridine-2-sulfonamide
CID 107807709
5-[(2-chloro-4-cyanophenyl)sulfamoyl]-1,3-thiazole-4-carboxylic acid
CID 107807132
N-(2-chloro-4-cyanophenyl)-4-(methylamino)pyridine-3-sulfonamide
CID 107810161
1-chloro-N-(2-chloro-4-cyanophenyl)methanesulfonamide
CID 107809713
N-(2-chloro-4-cyanophenyl)-3,4-dimethylbenzenesulfonamide
CID 103791853
N-(4-amino-2-chlorophenyl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 103413759
2-chloro-N-(4-chloro-2-methoxy-5-methylphenyl)-1,3-thiazole-5-sulfonamide
CID 43427486

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide (CID 107807707) is 2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide is N#Cc1ccc(NS(=O)(=O)c2cnc(Cl)s2)c(Cl)c1.
What is the InChIKey of 2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide?
The InChIKey is VBQZDNVCBQQTOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5Cl2N3O2S2/c11-7-3-6(4-13)1-2-8(7)15-19(16,17)9-5-14-10(12)18-9/h1-3,5,15H.
What are the key properties of 2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide?
2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide has a molecular weight of 334.21 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-chloro-4-cyanophenyl)-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 107807707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).