N-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide

C15H15N3O3S — CID 155546232

IUPACN-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide
SMILESCCS(=O)(=O)Nc1cc(-c2ccc(O)cc2)cc2[nH]ncc12
InChIInChI=1S/C15H15N3O3S/c1-2-22(20,21)18-15-8-11(7-14-13(15)9-16-17-14)10-3-5-12(19)6-4-10/h3-9,18-19H,2H2,1H3,(H,16,17)
InChIKeyZBQJHZWQJDQOIW-UHFFFAOYSA-N
MW317.37 g/mol
LogP2.70
Rot. Bonds4

About N-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide

N-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide (PubChem CID 155546232) has the molecular formula C15H15N3O3S and a molecular weight of 317.37 g/mol. Its IUPAC name is N-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide.

Molecular Properties

Compound NameN-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide
PubChem CID155546232
Molecular FormulaC15H15N3O3S
Molecular Weight317.37 g/mol
Exact Mass317.08
IUPAC NameN-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide
SMILESCCS(=O)(=O)Nc1cc(-c2ccc(O)cc2)cc2[nH]ncc12
InChIInChI=1S/C15H15N3O3S/c1-2-22(20,21)18-15-8-11(7-14-13(15)9-16-17-14)10-3-5-12(19)6-4-10/h3-9,18-19H,2H2,1H3,(H,16,17)
InChIKeyZBQJHZWQJDQOIW-UHFFFAOYSA-N
XLogP2.70
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.37
LogP ≤ 52.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide?
The IUPAC name of N-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide (CID 155546232) is N-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide.
What is the SMILES notation for N-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide?
The canonical SMILES for N-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide is CCS(=O)(=O)Nc1cc(-c2ccc(O)cc2)cc2[nH]ncc12.
What is the InChIKey of N-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide?
The InChIKey is ZBQJHZWQJDQOIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3S/c1-2-22(20,21)18-15-8-11(7-14-13(15)9-16-17-14)10-3-5-12(19)6-4-10/h3-9,18-19H,2H2,1H3,(H,16,17).
What are the key properties of N-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide?
N-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide has a molecular weight of 317.37 g/mol, XLogP of 2.70, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]ethanesulfonamide is sourced from PubChem (CID 155546232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).