4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide

C7H7N5O2S — CID 144893699

IUPAC4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide
SMILESNS(=O)c1ccc(O)cc1-c1nn[nH]n1
InChIInChI=1S/C7H7N5O2S/c8-15(14)6-2-1-4(13)3-5(6)7-9-11-12-10-7/h1-3,13H,8H2,(H,9,10,11,12)
InChIKeyQSKFFKSQWOOTAK-UHFFFAOYSA-N
MW225.23 g/mol
LogP-0.45
Rot. Bonds2

About 4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide

4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide (PubChem CID 144893699) has the molecular formula C7H7N5O2S and a molecular weight of 225.23 g/mol. Its IUPAC name is 4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide.

Molecular Properties

Compound Name4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide
PubChem CID144893699
Molecular FormulaC7H7N5O2S
Molecular Weight225.23 g/mol
Exact Mass225.03
IUPAC Name4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide
SMILESNS(=O)c1ccc(O)cc1-c1nn[nH]n1
InChIInChI=1S/C7H7N5O2S/c8-15(14)6-2-1-4(13)3-5(6)7-9-11-12-10-7/h1-3,13H,8H2,(H,9,10,11,12)
InChIKeyQSKFFKSQWOOTAK-UHFFFAOYSA-N
XLogP-0.45
TPSA117.78 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.23
LogP ≤ 5-0.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide?
The IUPAC name of 4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide (CID 144893699) is 4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide.
What is the SMILES notation for 4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide?
The canonical SMILES for 4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide is NS(=O)c1ccc(O)cc1-c1nn[nH]n1.
What is the InChIKey of 4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide?
The InChIKey is QSKFFKSQWOOTAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N5O2S/c8-15(14)6-2-1-4(13)3-5(6)7-9-11-12-10-7/h1-3,13H,8H2,(H,9,10,11,12).
What are the key properties of 4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide?
4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide has a molecular weight of 225.23 g/mol, XLogP of -0.45, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-2-(2H-tetrazol-5-yl)benzenesulfinamide is sourced from PubChem (CID 144893699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).