N-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide

C10H7ClN4O2S2 — CID 170949844

IUPACN-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide
SMILESO=S(=O)(Nc1cccc2c(Cl)[nH]nc12)c1cnsc1
InChIInChI=1S/C10H7ClN4O2S2/c11-10-7-2-1-3-8(9(7)13-14-10)15-19(16,17)6-4-12-18-5-6/h1-5,15H,(H,13,14)
InChIKeyKTVSTXKCCNBEAK-UHFFFAOYSA-N
MW314.78 g/mol
LogP2.47
Rot. Bonds3

About N-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide

N-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide (PubChem CID 170949844) has the molecular formula C10H7ClN4O2S2 and a molecular weight of 314.78 g/mol. Its IUPAC name is N-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide.

Molecular Properties

Compound NameN-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide
PubChem CID170949844
Molecular FormulaC10H7ClN4O2S2
Molecular Weight314.78 g/mol
Exact Mass313.97
IUPAC NameN-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide
SMILESO=S(=O)(Nc1cccc2c(Cl)[nH]nc12)c1cnsc1
InChIInChI=1S/C10H7ClN4O2S2/c11-10-7-2-1-3-8(9(7)13-14-10)15-19(16,17)6-4-12-18-5-6/h1-5,15H,(H,13,14)
InChIKeyKTVSTXKCCNBEAK-UHFFFAOYSA-N
XLogP2.47
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.78
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-N-(3-chloro-2H-indazol-7-yl)-1,3-thiazole-5-sulfonamide
CID 170949514
N-(3-chloro-1H-indol-7-yl)-1,2-thiazole-4-sulfonamide
CID 171055487
3-chloro-7-(trifluoromethyl)-2H-indazole
CID 105476798
N-[5-(benzenesulfonamido)naphthalen-1-yl]benzenesulfonamide
CID 3389796
6-chloro-N-naphthalen-1-ylpyridine-3-sulfonamide
CID 4729879
4-chloro-N-[3-chloro-7-(3-methylbut-2-enylamino)-2H-indazol-5-yl]benzenesulfonamide
CID 3011196
3-chloro-N-(1H-indazol-3-yl)benzenesulfonamide
CID 62686573
N-(2,1,3-benzoselenadiazol-4-yl)-2-chloropyrimidine-5-sulfonamide
CID 61051628
N-(3-chloro-1H-indol-7-yl)-4-(trifluoromethyl)-1,3-thiazole-2-sulfonamide
CID 171664660
3,5-dichloro-N-(1H-indazol-3-yl)benzenesulfonamide
CID 62686764
N-(3-chloro-2-methylphenyl)-4-fluorobenzenesulfonamide
CID 711089
3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide
CID 58496706

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide?
The IUPAC name of N-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide (CID 170949844) is N-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide.
What is the SMILES notation for N-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide?
The canonical SMILES for N-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide is O=S(=O)(Nc1cccc2c(Cl)[nH]nc12)c1cnsc1.
What is the InChIKey of N-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide?
The InChIKey is KTVSTXKCCNBEAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClN4O2S2/c11-10-7-2-1-3-8(9(7)13-14-10)15-19(16,17)6-4-12-18-5-6/h1-5,15H,(H,13,14).
What are the key properties of N-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide?
N-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide has a molecular weight of 314.78 g/mol, XLogP of 2.47, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2H-indazol-7-yl)-1,2-thiazole-4-sulfonamide is sourced from PubChem (CID 170949844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).