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(6-chloro-4H-1,3-benzodioxin-8-yl)methyl (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate

(6-chloro-4H-1,3-benzodioxin-8-yl)methyl (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate structure

CAS No:
957013-86-4
Formula:
C22H24ClNO5
Chemical Name:
(6-chloro-4H-1,3-benzodioxin-8-yl)methyl (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate
Synonyms:
ZINC2640272;AKOS034826912;MCULE-8853898968;Z56978591;(6-chloro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl (2S)-3-methyl-2-[(3-methylphenyl)formamido]butanoate;957013-86-4

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(6-chloro-4H-1,3-benzodioxin-8-yl)methyl (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate Basic Attributes

Molecular Weight：

417.9 g/mol

Exact Mass：

417.1343006 g/mol

Characteristics

PSA：

73.9 Å²

Computed Properties

Molecular Weight:417.9
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:417.1343006
Monoisotopic Mass:417.1343006
Topological Polar Surface Area:73.9
Heavy Atom Count:29
Complexity:571
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (6-chloro-4H-1,3-benzodioxin-8-yl)methyl (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate

Basic Attributes
Characteristics
Computed Properties
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