Barbituric acid, 5-hydroxy-5-thiosemicarbazide, hydrate structure

Barbituric acid, 5-hydroxy-5-thiosemicarbazide, hydrate

[(5-hydroxy-2,4,6-trioxo-1,3-diazinan-5-yl)amino]thiourea;hydrate

Also Known As: 5-Hydroxy-5-thiosemicarbazidebarbituric acid hydrate|BARBITURIC ACID, 5-HYDROXY-5-THIOSEMICARBAZIDE, HYDRATE|[(5-hydroxy-2,4,6-trioxo-1,3-diazinan-5-yl)amino]thiourea hydrate|2-(5-Hydroxy-2,4,6-trioxo-1,3-diazinan-5-yl)hydrazine-1-carbothioamide--water (1/1)|Hydrazinecarbothioamide, 2-(hexahydro-5-hydroxy-2,4,6-trioxo-5-pyrimidinyl)-, hydrate

CAS: 73681-08-0
Molecular Formula C5H9N5O5S
Molecular Weight 251.03244 g/mol
LogP -4.4459
Topological Polar Surface Area 177.08 Ų
Hydrogen Bond Donors 6
Hydrogen Bond Acceptors 6
Rotatable Bonds 2
Exact Mass 251.03244
Monoisotopic Mass 251.03244
Heavy Atoms 16
Complexity 337.11856

Chemical Identifiers

CAS Number 73681-08-0
SMILES C1(=O)C(C(=O)NC(=O)N1)(NNC(=S)N)O.O

Product Overview

Barbituric acid, 5-hydroxy-5-thiosemicarbazide, hydrate (CAS 73681-08-0), with molecular formula C5H9N5O5S and molecular weight 251.03244 g/mol. IUPAC: [(5-hydroxy-2,4,6-trioxo-1,3-diazinan-5-yl)amino]thiourea;hydrate.

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