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1-[2-(9-butylpurin-6-yl)sulfanylethyl]-3-methylurea

1-[2-(9-butylpurin-6-yl)sulfanylethyl]-3-methylurea structure

CAS No:
92100-66-8
Formula:
C13H20N6OS
Chemical Name:
1-[2-(9-butylpurin-6-yl)sulfanylethyl]-3-methylurea

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1-[2-(9-butylpurin-6-yl)sulfanylethyl]-3-methylurea Basic Attributes

Molecular Weight：

308.40300

Exact Mass：

308.14193046 g/mol

NSC Number：

76793

DSSTox ID：

DTXSID70291620

Characteristics

PSA：

110.03000

XLogP3：

2.42930

Density：

1.34g/cm3

Refractive Index：

1.662

Computed Properties

Molecular Weight:308.41
XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:308.14193046
Monoisotopic Mass:308.14193046
Topological Polar Surface Area:110
Heavy Atom Count:21
Complexity:332
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[2-(9-butylpurin-6-yl)sulfanylethyl]-3-methylurea

Basic Attributes
Characteristics
Computed Properties

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