 Home > Encyclopedia > 1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone structure

CAS No:
764699-14-1
Formula:
C21H22N4OS3
Chemical Name:
1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone
Synonyms:
ZINC2642531;AKOS002438342;MCULE-9378550726;Z14376575;1-{2,5-dimethyl-1-[(thiophen-2-yl)methyl]-1H-pyrrol-3-yl}-2-{[4-ethyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one;764699-14-1

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1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Basic Attributes

Molecular Weight：

442.6 g/mol

Exact Mass：

442.09557486 g/mol

Characteristics

PSA：

135 Å²

Computed Properties

Molecular Weight:442.6
XLogP3:4.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:442.09557486
Monoisotopic Mass:442.09557486
Topological Polar Surface Area:135
Heavy Atom Count:29
Complexity:568
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Basic Attributes
Characteristics
Computed Properties

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