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[2-(3,4-dimethoxyanilino)-2-oxoethyl] 3-phenylsulfanylpropanoate

[2-(3,4-dimethoxyanilino)-2-oxoethyl] 3-phenylsulfanylpropanoate structure

CAS No:
748785-83-3
Formula:
C19H21NO5S
Chemical Name:
[2-(3,4-dimethoxyanilino)-2-oxoethyl] 3-phenylsulfanylpropanoate
Synonyms:
MLS002251661;CHEMBL1714388;HMS3050J11;ZINC3263187;AKOS033653257;MCULE-5350088892;SMR001314049;Z18989508;[(3,4-dimethoxyphenyl)carbamoyl]methyl 3-(phenylsulfanyl)propanoate;748785-83-3

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[2-(3,4-dimethoxyanilino)-2-oxoethyl] 3-phenylsulfanylpropanoate Basic Attributes

Molecular Weight：

375.4 g/mol

Exact Mass：

375.11404394 g/mol

Characteristics

PSA：

99.2 Å²

Water Solubility：

55.5 [ug/mL]

Computed Properties

Molecular Weight:375.4
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:375.11404394
Monoisotopic Mass:375.11404394
Topological Polar Surface Area:99.2
Heavy Atom Count:26
Complexity:442
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Hot Searches: methyl benzoate; phenylmagnesium bromide; hcl sds; sec butanol; petroleum ether structure; triethyl phosphate

Guide of [2-(3,4-dimethoxyanilino)-2-oxoethyl] 3-phenylsulfanylpropanoate

Basic Attributes
Characteristics
Computed Properties
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