 Home > Encyclopedia > 4-[[4-amino-5-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-2-(1H-benzimidazol-2-yl)-3-hydroxybut-2-enenitrile

4-[[4-amino-5-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-2-(1H-benzimidazol-2-yl)-3-hydroxybut-2-enenitrile

4-[[4-amino-5-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-2-(1H-benzimidazol-2-yl)-3-hydroxybut-2-enenitrile structure

CAS No:
735295-70-2
Formula:
C20H16FN7OS
Chemical Name:
4-[[4-amino-5-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-2-(1H-benzimidazol-2-yl)-3-hydroxybut-2-enenitrile
Synonyms:
ZINC3288286;Z54902933;4-({4-amino-5-[(2-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-2-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-3-oxobutanenitrile;735295-70-2

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4-[[4-amino-5-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-2-(1H-benzimidazol-2-yl)-3-hydroxybut-2-enenitrile Basic Attributes

Molecular Weight：

421.5 g/mol

Exact Mass：

421.11210749 g/mol

Characteristics

PSA：

155 Å²

Computed Properties

Molecular Weight:421.5
XLogP3:2.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:421.11210749
Monoisotopic Mass:421.11210749
Topological Polar Surface Area:155
Heavy Atom Count:30
Complexity:685
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: ethyl benzoate; phosphoric acid formula; lithium acetate; potassium sulfide formula; clotrimazole tablet; viprostol

Guide of 4-[[4-amino-5-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-2-(1H-benzimidazol-2-yl)-3-hydroxybut-2-enenitrile

Basic Attributes
Characteristics
Computed Properties

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