1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[5-(3,4-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone
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![1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[5-(3,4-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/673809697ef544f49c4f3a8602a0abda.png "1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[5-(3,4-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone")
1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[5-(3,4-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone
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CAS No:
753462-64-5
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Formula:
C20H22N4O2S2
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Chemical Name:
1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[5-(3,4-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone
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Synonyms:
ZINC2658567;AKOS033656496;MCULE-3503238597;Z19048778;1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-({5-[(3,4-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)ethan-1-one;753462-64-5
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CAS No:
1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[5-(3,4-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Basic Attributes
414.5 g/mol
414.11841830 g/mol
Computed Properties
Molecular Weight:414.5
XLogP3:4.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:414.11841830
Monoisotopic Mass:414.11841830
Topological Polar Surface Area:141
Heavy Atom Count:28
Complexity:578
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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