 Home > Encyclopedia > 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone

1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone

1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone structure

CAS No:
727719-28-0
Formula:
C18H16ClN3O2S3
Chemical Name:
1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone
Synonyms:
ZINC3370309;AKOS033899952;MCULE-2679753861;Z24094702;1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-{[4-(4-chlorophenyl)-5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl]sulfanyl}ethan-1-one;727719-28-0

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1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Basic Attributes

Molecular Weight：

438.0 g/mol

Exact Mass：

437.0093180 g/mol

Characteristics

PSA：

148 Å²

Computed Properties

Molecular Weight:438.0
XLogP3:5.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:437.0093180
Monoisotopic Mass:437.0093180
Topological Polar Surface Area:148
Heavy Atom Count:27
Complexity:652
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone

Basic Attributes
Characteristics
Computed Properties

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