2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide

C10H6Cl2N4O2S2 — CID 170949514

IUPAC2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide
SMILESO=S(=O)(Nc1cccc2c(Cl)[nH]nc12)c1cnc(Cl)s1
InChIInChI=1S/C10H6Cl2N4O2S2/c11-9-5-2-1-3-6(8(5)14-15-9)16-20(17,18)7-4-13-10(12)19-7/h1-4,16H,(H,14,15)
InChIKeyLVSITJBEXKLLQF-UHFFFAOYSA-N
MW349.22 g/mol
LogP3.13
Rot. Bonds3

About 2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide

2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide (PubChem CID 170949514) has the molecular formula C10H6Cl2N4O2S2 and a molecular weight of 349.22 g/mol. Its IUPAC name is 2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide
PubChem CID170949514
Molecular FormulaC10H6Cl2N4O2S2
Molecular Weight349.22 g/mol
Exact Mass347.93
IUPAC Name2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide
SMILESO=S(=O)(Nc1cccc2c(Cl)[nH]nc12)c1cnc(Cl)s1
InChIInChI=1S/C10H6Cl2N4O2S2/c11-9-5-2-1-3-6(8(5)14-15-9)16-20(17,18)7-4-13-10(12)19-7/h1-4,16H,(H,14,15)
InChIKeyLVSITJBEXKLLQF-UHFFFAOYSA-N
XLogP3.13
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.22
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide
CID 170949844
2-chloro-N-(2-chlorophenyl)-1,3-thiazole-5-sulfonamide
CID 43427443
2-chloro-N-(2-ethylphenyl)-1,3-thiazole-5-sulfonamide
CID 43455810
2-chloro-N-(2-chloro-5-iodophenyl)-1,3-thiazole-5-sulfonamide
CID 114259497
2-chloro-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-5-sulfonamide
CID 43427475
2-chloro-N-(2-imidazol-1-ylphenyl)-1,3-thiazole-5-sulfonamide
CID 61052341
N-(1,3-benzothiazol-2-yl)-2-chloro-1,3-thiazole-5-sulfonamide
CID 43455882
N-(4-bromophenyl)-2-chloro-1,3-thiazole-5-sulfonamide
CID 43427435
2-chloro-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]-1,3-thiazole-5-sulfonamide
CID 61216389
2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]phenyl]sulfanylacetamide
CID 61052007
2-chloro-N-(3-sulfamoylphenyl)-1,3-thiazole-5-sulfonamide
CID 43427451
2-chloro-N-methyl-1,3-thiazole-5-sulfonamide
CID 43455781

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide (CID 170949514) is 2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide is O=S(=O)(Nc1cccc2c(Cl)[nH]nc12)c1cnc(Cl)s1.
What is the InChIKey of 2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide?
The InChIKey is LVSITJBEXKLLQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2N4O2S2/c11-9-5-2-1-3-6(8(5)14-15-9)16-20(17,18)7-4-13-10(12)19-7/h1-4,16H,(H,14,15).
What are the key properties of 2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide?
2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide has a molecular weight of 349.22 g/mol, XLogP of 3.13, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 170949514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).