Compound C12H16N3O2S+

5-[[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]methyl]-2-methyl-1H-pyrimidin-6-one

CAS: 136-16-3

Molecular Formula	`C12H16N3O2S+`
Molecular Weight	266.34 g/mol
LogP	0.1
Topological Polar Surface Area	93.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	4
Exact Mass	266.0963
Heavy Atoms	18
Complexity	395.0

Chemical Identifiers

CAS Number	136-16-3
SMILES	`CC1=C(SC=[N+]1CC2=CN=C(NC2=O)C)CCO`
InChIKey	`SRDGSXVLAVRBLU-UHFFFAOYSA-O`

📖 Product Overview

Compound C12H16N3O2S+ (CAS: 136-16-3) is a chemical compound with molecular formula C12H16N3O2S+ and molecular weight 266.34 g/mol. Its IUPAC systematic name is 5-[[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]methyl]-2-methyl-1H-pyrimidin-6-one. LogP 0.1 Topological Polar Surface Area 93.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 4 Exact Mass 266.0963 Heavy Atoms 18 Complexity 395.0 InChI Key: SRDGSXVLAVRBLU-UHFFFAOYSA-O. SMILES: CC1=C(SC=[N+]1CC2=CN=C(NC2=O)C)CCO.

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