2-(Methylsulfonyl)thiazolo[5,4-b]pyridine

HCID 3604503

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: CS(=O)(=O)c1nc2cccnc2s1
InChIKey: ZUSIIAIBKMYAOF-UHFFFAOYSA-N
Molecular formula: C7H6N2O2S2
Average molar mass: 214.3 g/mol
Monoisotopic mass: 213.98706979

Names & identifiers

Preferred name: 2-(Methylsulfonyl)thiazolo[5,4-b]pyridine
IUPAC: 2-methylsulfonyl-[1,3]thiazolo[5,4-b]pyridine

Names & synonyms

SCHEMBL8110164ZUSIIAIBKMYAOF-UHFFFAOYSA-N2-(methylsulfonyl)thiazolo[5,4-b]pyridine2-(methylsulfonyl)thiazolo-[5,4-b]pyridineAI-204/31680026methyl [1,3]thiazolo[5,4-b]pyridin-2-yl sulfoneZ1862019653

Database identifiers

PubChem CID: 3604503

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 96.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 285

Related reactions

7 records

New reaction record

HRID 477684As reactantuspto-grants-1989_12

HRID 692792As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

HRID 707275As productuspto-grants-2015_11

HRID 707383As reactantuspto-grants-2015_11

HRID 893690As reactantuspto-grants-1992_06

HRID 1493934As reactantuspto-grants-1991_06

HRID 2309525As reactantuspto-grants-1987_09

Compound notes

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