AC1MHYR7

(5-ethyl-3-methyl-2,4,6-trioxo-5-phenyl-1,3-diazinan-1-yl)methylthiourea;hydrobromide

Also Known As: 3-(2-Isothioureidomethyl)-1-methylphenobarbital hydrobromide|5-Ethyl-3-(2-isothioureidomethyl)-1-methyl-5-phenylbarbituric acid hydrobromide|Barbituric acid, 5-ethyl-3-(2-isothioureidomethyl)-1-methyl-5-phenyl-, hydrobromide|(5-ethyl-3-methyl-2,4,6-trioxo-5-phenyl-1,3-diazinan-1-yl)methylthiourea hydrobromide|N-[(5-Ethyl-3-methyl-2,4,6-trioxo-5-phenyl-1,3-diazinan-1-yl)methyl]carbamimidothioic acid--hydrogen bromide (1/1)|Thiourea, [(5-ethyltetrahydro-3-methyl-2,4,6-trioxo-5-phenyl-1(2H)-pyrimidinyl)methyl]-, monohydrobromide

Molecular Formula	C15H19BrN4O3S
Molecular Weight	414.03613 g/mol
LogP	1.1236
Topological Polar Surface Area	95.74 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	4
Exact Mass	414.03613
Monoisotopic Mass	414.03613
Heavy Atoms	24
Complexity	669.9428

Chemical Identifiers

CAS Number	64038-18-2
SMILES	CCC1(C(=O)N(C(=O)N(C1=O)CNC(=S)N)C)C2=CC=CC=C2.Br