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1-benzyl-3-isoquinolin-5-ylthiourea

1-benzyl-3-isoquinolin-5-ylthiourea structure

CAS No:
727706-53-8
Formula:
C17H15N3S
Chemical Name:
1-benzyl-3-isoquinolin-5-ylthiourea
Synonyms:
MLS001178214;CHEMBL1382381;HMS2915C13;ZINC3362358;AKOS034376773;MCULE-5042533480;3-benzyl-1-(isoquinolin-5-yl)thiourea;SMR000591369;SR-01000046416;SR-01000046416-1;Z45800142;727706-53-8

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1-benzyl-3-isoquinolin-5-ylthiourea Basic Attributes

Molecular Weight：

293.4 g/mol

Exact Mass：

293.09866866 g/mol

Characteristics

PSA：

69 Å²

Water Solubility：

>44 [ug/mL]

Computed Properties

Molecular Weight:293.4
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:293.09866866
Monoisotopic Mass:293.09866866
Topological Polar Surface Area:69
Heavy Atom Count:21
Complexity:341
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-benzyl-3-isoquinolin-5-ylthiourea

Basic Attributes
Characteristics
Computed Properties

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