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[4-(5-butyl-2,4,6-trioxo-1,3-diazinan-1-yl)cyclohexyl] benzoate

[4-(5-butyl-2,4,6-trioxo-1,3-diazinan-1-yl)cyclohexyl] benzoate structure

CAS No:
21330-98-3
Formula:
C21H26N2O5
Chemical Name:
[4-(5-butyl-2,4,6-trioxo-1,3-diazinan-1-yl)cyclohexyl] benzoate
Synonyms:
21330-98-3;BRN 0719798;DTXSID20943889;5-Butyl-1-(4-hydroxycyclohexyl)barbituric acid benzoate (ester);1-(4-Benzoyloxycyclohexyl)-5-butylperhydropyrimidine-2,4,5-trione;BARBITURIC ACID, 5-BUTYL-1-(4-HYDROXYCYCLOHEXYL)-, BENZOATE (ester);1-(4-Benzoyloxycyclohexyl)-5-butylbarbituric acid;4-(5-Butyl-4-hydroxy-2,6-dioxo-5,6-dihydropyrimidin-1(2H)-yl)cyclohexyl benzoate

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[4-(5-butyl-2,4,6-trioxo-1,3-diazinan-1-yl)cyclohexyl] benzoate Basic Attributes

Molecular Weight：

386.4 g/mol

Exact Mass：

386.18417193 g/mol

Characteristics

PSA：

92.8 Å²

Computed Properties

Molecular Weight:386.4
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:386.18417193
Monoisotopic Mass:386.18417193
Topological Polar Surface Area:92.8
Heavy Atom Count:28
Complexity:606
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [4-(5-butyl-2,4,6-trioxo-1,3-diazinan-1-yl)cyclohexyl] benzoate

Basic Attributes
Characteristics
Computed Properties
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