AC1N36HX structure

AC1N36HX

ethyl 4-[[2-[[5-[(4-piperidin-1-ylsulfonylbenzoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate

Also Known As: Oprea1_051478|F0417-0317|ethyl 4-[2-({5-[4-(piperidine-1-sulfonyl)benzamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamido]benzoate|ethyl 4-(2-((5-(4-(piperidin-1-ylsulfonyl)benzamido)-1,3,4-thiadiazol-2-yl)thio)acetamido)benzoate|ethyl 4-[[2-[[5-[(4-piperidin-1-ylsulfonylbenzoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate

CAS: 392293-41-3
Molecular Formula C25H27N5O6S3
Molecular Weight 589.11237 g/mol
LogP 3.8725
Topological Polar Surface Area 147.66 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 10
Rotatable Bonds 10
Exact Mass 589.11237
Monoisotopic Mass 589.11237
Heavy Atoms 39
Complexity 1419.1349

Chemical Identifiers

CAS Number 392293-41-3
SMILES CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Product Overview

AC1N36HX (CAS 392293-41-3), with molecular formula C25H27N5O6S3 and molecular weight 589.11237 g/mol. IUPAC: ethyl 4-[[2-[[5-[(4-piperidin-1-ylsulfonylbenzoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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