3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide

C15H15N3O3S — CID 71682141

IUPAC3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide
SMILESCCOc1ccc2[nH]nc(-c3cccc(S(N)(=O)=O)c3)c2c1
InChIInChI=1S/C15H15N3O3S/c1-2-21-11-6-7-14-13(9-11)15(18-17-14)10-4-3-5-12(8-10)22(16,19)20/h3-9H,2H2,1H3,(H,17,18)(H2,16,19,20)
InChIKeyXJNGZIGUKNHSJB-UHFFFAOYSA-N
MW317.37 g/mol
LogP2.28
Rot. Bonds4

About 3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide

3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide (PubChem CID 71682141) has the molecular formula C15H15N3O3S and a molecular weight of 317.37 g/mol. Its IUPAC name is 3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide
PubChem CID71682141
Molecular FormulaC15H15N3O3S
Molecular Weight317.37 g/mol
Exact Mass317.08
IUPAC Name3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide
SMILESCCOc1ccc2[nH]nc(-c3cccc(S(N)(=O)=O)c3)c2c1
InChIInChI=1S/C15H15N3O3S/c1-2-21-11-6-7-14-13(9-11)15(18-17-14)10-4-3-5-12(8-10)22(16,19)20/h3-9H,2H2,1H3,(H,17,18)(H2,16,19,20)
InChIKeyXJNGZIGUKNHSJB-UHFFFAOYSA-N
XLogP2.28
TPSA98.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.37
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(5-methoxy-1H-indazol-3-yl)benzenesulfonamide
CID 53476531
3-[5-(2-thiophen-2-ylethoxy)-1H-indazol-3-yl]benzenesulfonamide
CID 67454621
3-(5-phenylmethoxy-1H-indazol-3-yl)benzenesulfonamide
CID 68230037
3-(6-cyano-5-ethoxy-1H-indazol-3-yl)benzenesulfonamide
CID 71682142
3-(5-ethoxy-6-phenyl-1H-indazol-3-yl)benzenesulfonamide
CID 71682298
Mps1 Inhibitor I
CID 73345836
3-(6-fluoro-1H-indazol-3-yl)-N-(4-methoxyphenyl)benzenesulfonamide
CID 164609444
3-(6-fluoro-1H-indazol-3-yl)-N-(2-methoxyphenyl)benzenesulfonamide
CID 164628126
5-(benzyloxy)-1H-indazole
CID 12798088
N-(1H-indazol-6-yl)-4-methoxy-3-methylbenzenesulfonamide
CID 1507316
4-ethoxy-N-1H-indazol-6-yl-2,5-dimethylbenzenesulfonamide
CID 2237144
N-(3-chloro-7-ethoxy-2H-indazol-4-yl)-4-methoxybenzenesulfonamide
CID 71454169

Frequently Asked Questions

What is the IUPAC name of 3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide?
The IUPAC name of 3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide (CID 71682141) is 3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide.
What is the SMILES notation for 3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide?
The canonical SMILES for 3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide is CCOc1ccc2[nH]nc(-c3cccc(S(N)(=O)=O)c3)c2c1.
What is the InChIKey of 3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide?
The InChIKey is XJNGZIGUKNHSJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3S/c1-2-21-11-6-7-14-13(9-11)15(18-17-14)10-4-3-5-12(8-10)22(16,19)20/h3-9H,2H2,1H3,(H,17,18)(H2,16,19,20).
What are the key properties of 3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide?
3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide has a molecular weight of 317.37 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-ethoxy-1H-indazol-3-yl)benzenesulfonamide is sourced from PubChem (CID 71682141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).