2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide

C10H7Cl3N2O2S2 — CID 61053536

IUPAC2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide
SMILESCc1nc(Cl)sc1S(=O)(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C10H7Cl3N2O2S2/c1-5-9(18-10(13)14-5)19(16,17)15-8-6(11)3-2-4-7(8)12/h2-4,15H,1H3
InChIKeyAGEIEPKKEYWGCJ-UHFFFAOYSA-N
MW357.67 g/mol
LogP4.21
Rot. Bonds3

About 2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide

2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide (PubChem CID 61053536) has the molecular formula C10H7Cl3N2O2S2 and a molecular weight of 357.67 g/mol. Its IUPAC name is 2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide
PubChem CID61053536
Molecular FormulaC10H7Cl3N2O2S2
Molecular Weight357.67 g/mol
Exact Mass355.90
IUPAC Name2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide
SMILESCc1nc(Cl)sc1S(=O)(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C10H7Cl3N2O2S2/c1-5-9(18-10(13)14-5)19(16,17)15-8-6(11)3-2-4-7(8)12/h2-4,15H,1H3
InChIKeyAGEIEPKKEYWGCJ-UHFFFAOYSA-N
XLogP4.21
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.67
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-(2,6-dichloro-3-methylphenyl)-4-methyl-1,3-thiazole-5-sulfonamide
CID 43456130
N-(5-bromo-2-chlorophenyl)-2-chloro-4-methyl-1,3-thiazole-5-sulfonamide
CID 62908053
2-chloro-4-methyl-N-(4-propan-2-ylphenyl)-1,3-thiazole-5-sulfonamide
CID 43415353
2-chloro-4-methyl-N-quinolin-5-yl-1,3-thiazole-5-sulfonamide
CID 43456143
2-chloro-4-methyl-N-(3-methyl-4-pyridinyl)-1,3-thiazole-5-sulfonamide
CID 55233131
2-chloro-4-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-5-sulfonamide
CID 79240768
2-chloro-N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-methyl-1,3-thiazole-5-sulfonamide
CID 114387374
2-chloro-N-(2-fluoro-4-methylphenyl)-4-methyl-1,3-thiazole-5-sulfonamide
CID 43456195
2-chloro-N-(4-chloro-3-nitrophenyl)-4-methyl-1,3-thiazole-5-sulfonamide
CID 61051495
2-chloro-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide
CID 43415374
2-chloro-N-[3-(dimethylamino)-4-methylphenyl]-4-methyl-1,3-thiazole-5-sulfonamide
CID 115376859
2-chloro-N-[4-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide
CID 43415373

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide (CID 61053536) is 2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide is Cc1nc(Cl)sc1S(=O)(=O)Nc1c(Cl)cccc1Cl.
What is the InChIKey of 2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide?
The InChIKey is AGEIEPKKEYWGCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7Cl3N2O2S2/c1-5-9(18-10(13)14-5)19(16,17)15-8-6(11)3-2-4-7(8)12/h2-4,15H,1H3.
What are the key properties of 2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide?
2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide has a molecular weight of 357.67 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 61053536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).