Sabeluzole, (S)-

Base Information

• Chemical Name: Sabeluzole, (S)-
• CAS No.: 104712-64-3
• Molecular Formula: C22H26 F N3 O2 S
• Molecular Weight: 415.53
• UNII: 4K6V9R4676
• ChEMBL ID: CHEMBL4794853
• Wikidata: Q27259825

Synonyms:Sabeluzole, (S)-;104712-64-3;4K6V9R4676;UNII-4K6V9R4676;R-84440;(S)-4-[(Benzothiazol-2-yl)methylamino]-alpha-[(4-fluorophenoxy)methyl]-1-piperidineethanol;1-Piperidineethanol, 4-(2-benzothiazolylmethylamino)-alpha-((4-fluorophenoxy)methyl)-, (S)-;(2S)-1-[4-[1,3-benzothiazol-2-yl(methyl)amino]piperidin-1-yl]-3-(4-fluorophenoxy)propan-2-ol;1-Piperidineethanol, 4-(2-benzothiazolylmethylamino)-alpha-((4-fluorophenoxy)methyl)-, (alphaS)-;(S)-sabeluzole;CHEMBL4794853;Q27259825;1-PIPERIDINEETHANOL, 4-(2-BENZOTHIAZOLYLMETHYLAMINO)-.ALPHA.-((4-FLUOROPHENOXY)METHYL)-, (.ALPHA.S)-;1-PIPERIDINEETHANOL, 4-(2-BENZOTHIAZOLYLMETHYLAMINO)-.ALPHA.-((4-FLUOROPHENOXY)METHYL)-, (S)-

Chemical Property of Sabeluzole, (S)-

Chemical Property:

• PSA: 77.07000
• LogP: 3.71380
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 415.17297642
• Heavy Atom Count: 29
• Complexity: 500

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CN(C1CCN(CC1)CC(COC2=CC=C(C=C2)F)O)C3=NC4=CC=CC=C4S3
• Isomeric SMILES: CN(C1CCN(CC1)C[C@@H](COC2=CC=C(C=C2)F)O)C3=NC4=CC=CC=C4S3

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