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[2-oxo-2-(3-phenylpropylamino)ethyl] 4-(1-methyltetrazol-5-yl)sulfanyl-3-nitrobenzoate

[2-oxo-2-(3-phenylpropylamino)ethyl] 4-(1-methyltetrazol-5-yl)sulfanyl-3-nitrobenzoate structure

CAS No:
785704-62-3
Formula:
C20H20N6O5S
Chemical Name:
[2-oxo-2-(3-phenylpropylamino)ethyl] 4-(1-methyltetrazol-5-yl)sulfanyl-3-nitrobenzoate
Synonyms:
ZINC2628826;AKOS033923083;MCULE-6597326165;Z24743592;[(3-phenylpropyl)carbamoyl]methyl 4-[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]-3-nitrobenzoate;785704-62-3

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[2-oxo-2-(3-phenylpropylamino)ethyl] 4-(1-methyltetrazol-5-yl)sulfanyl-3-nitrobenzoate Basic Attributes

Molecular Weight：

456.5 g/mol

Exact Mass：

456.12158893 g/mol

Characteristics

PSA：

170 Å²

Computed Properties

Molecular Weight:456.5
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:10
Exact Mass:456.12158893
Monoisotopic Mass:456.12158893
Topological Polar Surface Area:170
Heavy Atom Count:32
Complexity:645
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Hot Searches: ethoxide; t butyl alcohol; poly methyl acrylate; epoxidized soybean oil asphalt amine epoxy; ethyl bromide; l-methionine

Guide of [2-oxo-2-(3-phenylpropylamino)ethyl] 4-(1-methyltetrazol-5-yl)sulfanyl-3-nitrobenzoate

Basic Attributes
Characteristics
Computed Properties
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