 Home > Encyclopedia > ethyl 2-[[2-[[5-[(4-chloro-3-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate

ethyl 2-[[2-[[5-[(4-chloro-3-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate

ethyl 2-[[2-[[5-[(4-chloro-3-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate structure

CAS No:
750600-99-8
Formula:
C21H21ClN4O4S
Chemical Name:
ethyl 2-[[2-[[5-[(4-chloro-3-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
Synonyms:
ZINC2650875;AKOS033796163;MCULE-6887847230;Z21986383;750600-99-8;ethyl 2-[2-({5-[(4-chloro-3-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamido]benzoate

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ethyl 2-[[2-[[5-[(4-chloro-3-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate Basic Attributes

Molecular Weight：

460.9 g/mol

Exact Mass：

460.0972040 g/mol

Characteristics

PSA：

132 Å²

Computed Properties

Molecular Weight:460.9
XLogP3:5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:460.0972040
Monoisotopic Mass:460.0972040
Topological Polar Surface Area:132
Heavy Atom Count:31
Complexity:602
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-[[2-[[5-[(4-chloro-3-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate

Basic Attributes
Characteristics
Computed Properties
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