SB-742457 50mg

CAT: 0628-A14092-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0628-A14092-50Size:50 mg

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CAS Number

607742-69-8

Chemical Information

Intepirdine

Intepirdine has been used in trials studying the treatment of Alzheimer's Disease.

CAS Number	607742-69-8
PubChem CID	11256720
IUPAC Name	3-(benzenesulfonyl)-8-piperazin-1-ylquinoline
Molecular Formula	C19H19N3O2S
Molecular Weight	353.4
XLogP	2.5
Topological Polar Surface Area	70.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Heavy Atom Count	25
Formal Charge	0
Complexity	535

SMILES

C1CN(CCN1)C2=CC=CC3=CC(=CN=C32)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H19N3O2S/c23-25(24,16-6-2-1-3-7-16)17-13-15-5-4-8-18(19(15)21-14-17)22-11-9-20-10-12-22/h1-8,13-14,20H,9-12H2

InChIKey

JJZFWROHYSMCMU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 607742-69-8

CID: 11256720

Formula: C19H19N3O2S

MW: 353.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	353.4
XLogP3	2.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	353.11979803
Monoisotopic Mass	353.11979803
Topological Polar Surface Area	70.7 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	535
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
9568-5	SB-742457
MBS575887	SB 742457
GTR19153626-01	SB-269970, SB 269970
217783	SB-277011-A Dihydrochloride (SB277011A, SB 277011A, Dopamine D3 Receptor Antagonist, SB-277011-A, SB-277011A)
366911-01	SB 216763 (SB216763, SB-216763, SCHEMBL30251)
BA5664-5	SB-649868
BA8268-10	SB-435495
B6710-10	SB 218795
BA5318-1	SB-209670
B8200-5	SB 225002