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[2-oxo-2-(3-phenylpropylamino)ethyl] 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate

[2-oxo-2-(3-phenylpropylamino)ethyl] 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate structure

CAS No:
744259-78-7
Formula:
C27H28N2O5S
Chemical Name:
[2-oxo-2-(3-phenylpropylamino)ethyl] 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate
Synonyms:
ZINC2635795;AKOS033428939;MCULE-7911145303;Z15611640;[(3-phenylpropyl)carbamoyl]methyl 4-(1,2,3,4-tetrahydroisoquinoline-2-sulfonyl)benzoate;744259-78-7

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[2-oxo-2-(3-phenylpropylamino)ethyl] 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate Basic Attributes

Molecular Weight：

492.6 g/mol

Exact Mass：

492.17189317 g/mol

Characteristics

PSA：

101 Å²

Computed Properties

Molecular Weight:492.6
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:492.17189317
Monoisotopic Mass:492.17189317
Topological Polar Surface Area:101
Heavy Atom Count:35
Complexity:797
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-oxo-2-(3-phenylpropylamino)ethyl] 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate

Basic Attributes
Characteristics
Computed Properties
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