AS-605240 200mg

CAT: 0628-A10088-200Size: 200 mgDry Ice: NoHazardous: No

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CAT#:0628-A10088-200Size:200 mg

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CAS Number

648450-29-7

Chemical Information

AS-605240

5-(6-quinoxalinylmethylidene)thiazolidine-2,4-dione is a quinoxaline derivative.

CAS Number	648450-29-7
PubChem CID	10377751
IUPAC Name	(5E)-5-(quinoxalin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione
Molecular Formula	C12H7N3O2S
Molecular Weight	257.27
XLogP	1.5
Topological Polar Surface Area	97.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Heavy Atom Count	18
Formal Charge	0
Complexity	410

SMILES

C1=CC2=NC=CN=C2C=C1/C=C/3\C(=O)NC(=O)S3

InChI

InChI=1S/C12H7N3O2S/c16-11-10(18-12(17)15-11)6-7-1-2-8-9(5-7)14-4-3-13-8/h1-6H,(H,15,16,17)/b10-6+

InChIKey

SQWZFLMPDUSYGV-UXBLZVDNSA-N

Chemical Structure

2D Structure

CAS: 648450-29-7

CID: 10377751

Formula: C12H7N3O2S

MW: 257.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	257.27
XLogP3	1.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Exact Mass	257.02589765
Monoisotopic Mass	257.02589765
Topological Polar Surface Area	97.3 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	410
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
A5176-50	AS-605240
MBS130003-01	AS 605240