5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide

C11H8ClN3O2S2 — CID 2444866

IUPAC5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc2cn[nH]c2c1)c1ccc(Cl)s1
InChIInChI=1S/C11H8ClN3O2S2/c12-10-3-4-11(18-10)19(16,17)15-8-2-1-7-6-13-14-9(7)5-8/h1-6,15H,(H,13,14)
InChIKeyHUMQVNPSOFYCGX-UHFFFAOYSA-N
MW313.79 g/mol
LogP3.08
Rot. Bonds3

About 5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide

5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide (PubChem CID 2444866) has the molecular formula C11H8ClN3O2S2 and a molecular weight of 313.79 g/mol. Its IUPAC name is 5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide
PubChem CID2444866
Molecular FormulaC11H8ClN3O2S2
Molecular Weight313.79 g/mol
Exact Mass312.97
IUPAC Name5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc2cn[nH]c2c1)c1ccc(Cl)s1
InChIInChI=1S/C11H8ClN3O2S2/c12-10-3-4-11(18-10)19(16,17)15-8-2-1-7-6-13-14-9(7)5-8/h1-6,15H,(H,13,14)
InChIKeyHUMQVNPSOFYCGX-UHFFFAOYSA-N
XLogP3.08
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.79
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide (CID 2444866) is 5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide is O=S(=O)(Nc1ccc2cn[nH]c2c1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide?
The InChIKey is HUMQVNPSOFYCGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClN3O2S2/c12-10-3-4-11(18-10)19(16,17)15-8-2-1-7-6-13-14-9(7)5-8/h1-6,15H,(H,13,14).
What are the key properties of 5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide?
5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide has a molecular weight of 313.79 g/mol, XLogP of 3.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 2444866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).