 Home > Encyclopedia > ethyl 5-[2-[[5-(4-fluorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

ethyl 5-[2-[[5-(4-fluorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

ethyl 5-[2-[[5-(4-fluorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate structure

CAS No:
731789-07-4
Formula:
C22H23FN4O3S
Chemical Name:
ethyl 5-[2-[[5-(4-fluorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
Synonyms:
ZINC3364762;AKOS033733064;MCULE-2873877613;AB00717953-01;Z20142102;731789-07-4;ethyl 5-(2-{[5-(4-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

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ethyl 5-[2-[[5-(4-fluorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Basic Attributes

Molecular Weight：

442.5 g/mol

Exact Mass：

442.14748994 g/mol

Characteristics

PSA：

115 Å²

Computed Properties

Molecular Weight:442.5
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:442.14748994
Monoisotopic Mass:442.14748994
Topological Polar Surface Area:115
Heavy Atom Count:31
Complexity:646
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 5-[2-[[5-(4-fluorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Basic Attributes
Characteristics
Computed Properties
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