Acetic acid, ((4-(diethylamino)-6-methyl-2-pyrimidinyl)thio)-, hydrazide

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Basic information

CAS: 77965-39-0
Standard SMILES: CCN(CC)c1cc(C)nc(SCC(=O)NN)n1
InChIKey: ZHZZBTFMZIKEGT-UHFFFAOYSA-N
Molecular formula: C11H19N5OS
Average molar mass: 269.37 g/mol
Monoisotopic mass: 269.13103142

Names & identifiers

Preferred name: Acetic acid, ((4-(diethylamino)-6-methyl-2-pyrimidinyl)thio)-, hydrazide
IUPAC: 2-[4-(diethylamino)-6-methylpyrimidin-2-yl]sulfanylacetohydrazide

Names & synonyms

BRN 5078847ACETIC ACID, ((4-(DIETHYLAMINO)-6-METHYL-2-PYRIMIDINYL)THIO)-, HYDRAZIDE77965-39-0(4-Diethylamino-6-methyl-2-pyrimidinylthio)acethydrazideDTXSID00228626((4-(Diethylamino)-6-methyl-2-pyrimidinyl)thio)acetic acid hydrazideRefChem:315962DTXCID501511172-{[4-(diethylamino)-6-methylpyrimidin-2-yl]sulfanyl}acetohydrazide

Database identifiers

CAS: 77965-39-0
PubChem CID: 53860
DTXSID: DTXSID00228626
Nikkaji: J70.984K

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 109 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 6
Rotatable bonds: 6
Heavy atoms: 18
Formal charge: 0
Complexity: 262

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Compound notes

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