(5E)-5-(quinoxalin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione

(5E)-5-(quinoxalin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione

CAS: 648450-29-7

Formula: C12H7N3O2S

SMILES: O=C1NC(=O)C(S1)=C/C1=CC2=NC=CN=C2C=C1

IUPAC: (5E)-5-[(quinoxalin-6-yl)methylidene]-1,3-thiazolidine-2,4-dione

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+

Composition: C (56.02%), H (2.74%), N (16.33%), O (12.44%), S (12.46%)

Molar Mass: 257.27

Atom Count: 25

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	257.025897651
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	SQWZFLMPDUSYGV-UXBLZVDNSA-N
Lipinski's Rule of Five	1
Molar Refractivity	67.61
Topological Polar Surface Area	71.95
Polarizability	26.84
Ring Count	3
Rotatable Bond Count	1

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