AC1MQKSV structure

AC1MQKSV

6-methyl-5-(piperidin-1-ylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one

Also Known As: 5-piperidinomethyl-6-methyl-2-thiouracil|J2.860.223E|6-methyl-5-(piperidin-1-ylmethyl)-2-sulfanylidene-1H-pyrimid|6-Methyl-5-[(piperidin-1-yl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one|2-Thioxo-5-(piperidinomethyl)-6-methyl-1,2,3,4-tetrahydropyrimidine-4-one|6-methyl-5-(piperidin-1-ylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one|6-methyl-5-[(piperidin-1-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one

CAS: 29228-83-9
Molecular Formula C11H17N3OS
Molecular Weight 239.10924 g/mol
LogP 1.72681
Topological Polar Surface Area 51.89 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
Rotatable Bonds 2
Exact Mass 239.10924
Monoisotopic Mass 239.10924
Heavy Atoms 16
Complexity 470.8534

Chemical Identifiers

CAS Number 29228-83-9
SMILES CC1=C(C(=O)NC(=S)N1)CN2CCCCC2

Product Overview

AC1MQKSV (CAS 29228-83-9), with molecular formula C11H17N3OS and molecular weight 239.10924 g/mol. IUPAC: 6-methyl-5-(piperidin-1-ylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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