2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(1,3-benzothiazol-2-yl)butanamide

2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(1,3-benzothiazol-2-yl)butanamide

Formula: C13H13N5OS3

SMILES: CCC(SC1=NN=C(N)S1)C(=O)NC1=NC2=CC=CC=C2S1

IUPAC: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(1,3-benzothiazol-2-yl)butanamide

InChI: InChI=1/C13H13N5OS3/c1-2-8(21-13-18-17-11(14)22-13)10(19)16-12-15-7-5-3-4-6-9(7)20-12/h3-6,8H,2H2,1H3,(H2,14,17)(H,15,16,19)

Composition: C (44.43%), H (3.73%), N (19.93%), O (4.55%), S (27.37%)

Molar Mass: 351.46

Atom Count: 35

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	351.028223581
Formal Charge	0
FSP3	0.23
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	LFPARGABZDRYIA-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	91.87
Topological Polar Surface Area	93.79
Polarizability	34.96
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H13N5OS3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00