4-chloro-2-methylindazole-3-sulfonamide

C8H8ClN3O2S — CID 19083177

IUPAC4-chloro-2-methylindazole-3-sulfonamide
SMILESCn1nc2cccc(Cl)c2c1S(N)(=O)=O
InChIInChI=1S/C8H8ClN3O2S/c1-12-8(15(10,13)14)7-5(9)3-2-4-6(7)11-12/h2-4H,1H3,(H2,10,13,14)
InChIKeyQFAZRLSOZNNJIF-UHFFFAOYSA-N
MW245.69 g/mol
LogP0.87
Rot. Bonds1

About 4-chloro-2-methylindazole-3-sulfonamide

4-chloro-2-methylindazole-3-sulfonamide (PubChem CID 19083177) has the molecular formula C8H8ClN3O2S and a molecular weight of 245.69 g/mol. Its IUPAC name is 4-chloro-2-methylindazole-3-sulfonamide.

Molecular Properties

Compound Name4-chloro-2-methylindazole-3-sulfonamide
PubChem CID19083177
Molecular FormulaC8H8ClN3O2S
Molecular Weight245.69 g/mol
Exact Mass245.00
IUPAC Name4-chloro-2-methylindazole-3-sulfonamide
SMILESCn1nc2cccc(Cl)c2c1S(N)(=O)=O
InChIInChI=1S/C8H8ClN3O2S/c1-12-8(15(10,13)14)7-5(9)3-2-4-6(7)11-12/h2-4H,1H3,(H2,10,13,14)
InChIKeyQFAZRLSOZNNJIF-UHFFFAOYSA-N
XLogP0.87
TPSA77.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.69
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-methylindazole-3-sulfonamide?
The IUPAC name of 4-chloro-2-methylindazole-3-sulfonamide (CID 19083177) is 4-chloro-2-methylindazole-3-sulfonamide.
What is the SMILES notation for 4-chloro-2-methylindazole-3-sulfonamide?
The canonical SMILES for 4-chloro-2-methylindazole-3-sulfonamide is Cn1nc2cccc(Cl)c2c1S(N)(=O)=O.
What is the InChIKey of 4-chloro-2-methylindazole-3-sulfonamide?
The InChIKey is QFAZRLSOZNNJIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN3O2S/c1-12-8(15(10,13)14)7-5(9)3-2-4-6(7)11-12/h2-4H,1H3,(H2,10,13,14).
What are the key properties of 4-chloro-2-methylindazole-3-sulfonamide?
4-chloro-2-methylindazole-3-sulfonamide has a molecular weight of 245.69 g/mol, XLogP of 0.87, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-methylindazole-3-sulfonamide is sourced from PubChem (CID 19083177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).