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5-(3-methylbutyl)-5-propyl-1,3-diazinane-2,4,6-trione

5-(3-methylbutyl)-5-propyl-1,3-diazinane-2,4,6-trione structure

CAS No:
17013-42-2
Formula:
C12H20N2O3
Chemical Name:
5-(3-methylbutyl)-5-propyl-1,3-diazinane-2,4,6-trione
Synonyms:
Barbituric acid, 5-isopentyl-5-propyl-;17013-42-2;UNII-G52M4U6CMB;G52M4U6CMB;5-Isopentyl-5-propylbarbituric acid;NSC 120840;BRN 0021745;2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3-methylbutyl)-5-propyl-;NSC120840;Isoamyl-propyl-barbitursaure;CHEMBL3276726;DTXSID50168806;5-Isoamyl-5-propylbarbituric acid;ZINC1710350;NSC-120840;5-(3-Methylbutyl)-5-propylbarbituric acid;DS-003571;2,6(1H,3H,5H)-Pyrimidinetrione, 5-(3-methylbutyl)-5-propyl-;2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3-methylbutyl)-5-propyl- (9CI);2,4,6(1H,3H,5H)-PYRIMIDINETRIONE,5-(3-METHYLBUTYL)-5-PROPYL-

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5-(3-methylbutyl)-5-propyl-1,3-diazinane-2,4,6-trione Basic Attributes

Molecular Weight：

240.30 g/mol

Exact Mass：

240.14739250 g/mol

UNII：

G52M4U6CMB

NSC Number：

120840

DSSTox ID：

DTXSID50168806

Characteristics

PSA：

75.3 Å²

Computed Properties

Molecular Weight:240.30
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:240.14739250
Monoisotopic Mass:240.14739250
Topological Polar Surface Area:75.3
Heavy Atom Count:17
Complexity:317
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(3-methylbutyl)-5-propyl-1,3-diazinane-2,4,6-trione

Basic Attributes
Characteristics
Computed Properties

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