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Benzoic acid, 4-[[2-[[3,5-bis(trifluoromethyl)benzoyl]amino]-3-methyl-1-oxopentyl]amino]-, ethyl ester (9CI)

Benzoic acid, 4-[[2-[[3,5-bis(trifluoromethyl)benzoyl]amino]-3-methyl-1-oxopentyl]amino]-, ethyl ester (9CI) structure

CAS No:
334830-41-0
Formula:
C24H24F6N2O4
Chemical Name:
Benzoic acid, 4-[[2-[[3,5-bis(trifluoromethyl)benzoyl]amino]-3-methyl-1-oxopentyl]amino]-, ethyl ester (9CI)
Synonyms:
Ethyl 4-({N-[3,5-bis(trifluoromethyl)benzoyl]isoleucyl}amino)benzoate;ZINC34972685

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Benzoic acid, 4-[[2-[[3,5-bis(trifluoromethyl)benzoyl]amino]-3-methyl-1-oxopentyl]amino]-, ethyl ester (9CI) Basic Attributes

Molecular Weight：

518.4487792

Exact Mass：

518.164

Characteristics

PSA：

84.5

XLogP3：

5.8

Computed Properties

Molecular Weight:518.4
XLogP3:5.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:9
Exact Mass:518.16402622
Monoisotopic Mass:518.16402622
Topological Polar Surface Area:84.5
Heavy Atom Count:36
Complexity:743
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Benzoic acid, 4-[[2-[[3,5-bis(trifluoromethyl)benzoyl]amino]-3-methyl-1-oxopentyl]amino]-, ethyl ester (9CI)

Basic Attributes
Characteristics
Computed Properties
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