Compound C12H15NO3S2

S-[[4-(acetylsulfanylmethyl)-5-hydroxy-6-methyl-3-pyridinyl]methyl] ethanethioate

CAS: 78232-26-5

Molecular Formula	`C12H15NO3S2`
Molecular Weight	285.4 g/mol
LogP	0.9
Topological Polar Surface Area	118.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	285.04935
Heavy Atoms	18
Complexity	312.0

Chemical Identifiers

CAS Number	78232-26-5
SMILES	`CC1=NC=C(C(=C1O)CSC(=O)C)CSC(=O)C`
InChIKey	`ARDUHCGSOAFUTR-UHFFFAOYSA-N`

📖 Product Overview

Compound C12H15NO3S2 (CAS: 78232-26-5) is a chemical compound with molecular formula C12H15NO3S2 and molecular weight 285.4 g/mol. Its IUPAC systematic name is S-[[4-(acetylsulfanylmethyl)-5-hydroxy-6-methyl-3-pyridinyl]methyl] ethanethioate. LogP 0.9 Topological Polar Surface Area 118.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 6 Exact Mass 285.04935 Heavy Atoms 18 Complexity 312.0 InChI Key: ARDUHCGSOAFUTR-UHFFFAOYSA-N. SMILES: CC1=NC=C(C(=C1O)CSC(=O)C)CSC(=O)C.

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