N-(1,3-benzothiazol-2-yl)-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetamide

N-(1,3-benzothiazol-2-yl)-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetamide

Formula: C12H11N3OS3

SMILES: O=C(CSC1=NCCS1)NC1=NC2=CC=CC=C2S1

IUPAC: N-(1,3-benzothiazol-2-yl)-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetamide

InChI: InChI=1S/C12H11N3OS3/c16-10(7-18-12-13-5-6-17-12)15-11-14-8-3-1-2-4-9(8)19-11/h1-4H,5-7H2,(H,14,15,16)

Composition: C (46.58%), H (3.58%), N (13.58%), O (5.17%), S (31.08%)

Molar Mass: 309.42

Atom Count: 30

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	309.006425508
Formal Charge	0
FSP3	0.25
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	NEHDPTGPIWJZLO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	81.87
Topological Polar Surface Area	54.35
Polarizability	32.22
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H11N3OS3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00