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SZL P1-41 5mg

CAT: 0628-A20521-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0628-A20521-5Size:5 mg
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CAS Number
222716-34-9

Chemical Information

3-(1,3-benzothiazol-2-yl)-6-ethyl-7-hydroxy-8-((piperidin-1-yl)methyl)-4H-chromen-4-one

SZL-P1-41 is a chromone that is 3-(1,3-benzothiazol-2-yl)-8-(1-piperidinylmethyl)chromen-4-one bearing additional ethyl and hydroxy substituents at positions 6 and 7 respectively. It has a role as an antineoplastic agent and an EC 6.3.2.19 (ubiquitin--protein ligase) inhibitor. It is a member of chromones, a member of piperidines, a member of phenols and a member of benzothiazoles.

CAS Number222716-34-9
PubChem CID1286902
IUPAC Name3-(1,3-benzothiazol-2-yl)-6-ethyl-7-hydroxy-8-(piperidin-1-ylmethyl)chromen-4-one
Molecular FormulaC24H24N2O3S
Molecular Weight420.5
XLogP4.8
Topological Polar Surface Area90.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count30
Formal Charge0
Complexity665
SMILES
CCC1=CC2=C(C(=C1O)CN3CCCCC3)OC=C(C2=O)C4=NC5=CC=CC=C5S4
InChI
InChI=1S/C24H24N2O3S/c1-2-15-12-16-22(28)18(24-25-19-8-4-5-9-20(19)30-24)14-29-23(16)17(21(15)27)13-26-10-6-3-7-11-26/h4-5,8-9,12,14,27H,2-3,6-7,10-11,13H2,1H3
InChIKey
JKIXLEKBXHMXTN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(1,3-benzothiazol-2-yl)-6-ethyl-7-hydroxy-8-((piperidin-1-yl)methyl)-4H-chromen-4-one
CAS: 222716-34-9
CID: 1286902
Formula: C24H24N2O3S
MW: 420.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight420.5
XLogP34.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass420.15076381
Monoisotopic Mass420.15076381
Topological Polar Surface Area90.9 Ų
Heavy Atom Count30
Formal Charge0
Complexity665
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
B7745-5.1SZL P1-41
562992SZL-P1-41
HY-100237RSZL P1-41 (Standard)
5-01675P1

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