 Home > Encyclopedia > N-[(2S)-1-[[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide

N-[(2S)-1-[[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide

N-[(2S)-1-[[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide structure

CAS No:
956047-60-2
Formula:
C22H23FN4O2S2
Chemical Name:
N-[(2S)-1-[[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide
Synonyms:
ZINC2639650;AKOS034827359;MCULE-3570066199;Z57013052;(2S)-N-(5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methyl-2-[(3-methylphenyl)formamido]butanamide;956047-60-2

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N-[(2S)-1-[[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide Basic Attributes

Molecular Weight：

458.6 g/mol

Exact Mass：

458.12464650 g/mol

Characteristics

PSA：

138 Å²

Computed Properties

Molecular Weight:458.6
XLogP3:5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:458.12464650
Monoisotopic Mass:458.12464650
Topological Polar Surface Area:138
Heavy Atom Count:31
Complexity:604
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[(2S)-1-[[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide

Basic Attributes
Characteristics
Computed Properties

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