(1,2,4)Triazino(3,4-c)(1,4)benzothiazin-2(1H)-one, 3,5-dihydro-7-methyl-

HCID 3071999

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Basic information

CAS: 139605-57-5
Standard SMILES: Cc1cccc2c1SCC1=NNC(=O)CN12
InChIKey: SFCAHUBDAHSYMV-UHFFFAOYSA-N
Molecular formula: C11H11N3OS
Average molar mass: 233.29 g/mol
Monoisotopic mass: 233.06228316

Names & identifiers

Preferred name: (1,2,4)Triazino(3,4-c)(1,4)benzothiazin-2(1H)-one, 3,5-dihydro-7-methyl-
IUPAC: 7-methyl-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one

Names & synonyms

(1,2,4)Triazino(3,4-c)(1,4)benzothiazin-2(1H)-one, 3,5-dihydro-7-methyl-3,5-Dihydro-7-methyl-(1,2,4)triazino(3,4-c)(1,4)benzothiazin-2(1H)-one139605-57-5DTXSID80161128RefChem:204133DTXCID10836197-Methyl-3,5-dihydro[1,2,4]triazino[3,4-c][1,4]benzothiazin-2(1H)-one

Database identifiers

CAS: 139605-57-5
PubChem CID: 3071999
DTXSID: DTXSID80161128

Properties

Computed structural properties

XLogP: 1.4
Topological polar surface area: 70 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 0
Heavy atoms: 16
Formal charge: 0
Complexity: 344

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