N-(5-{[4-(dimethylamino)phenyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide

N-(5-{[4-(dimethylamino)phenyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide

Formula: C14H18N4OS2

SMILES: CCCC(=O)NC1=NN=C(SC2=CC=C(C=C2)N(C)C)S1

IUPAC: N-(5-{[4-(dimethylamino)phenyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide

InChI: InChI=1S/C14H18N4OS2/c1-4-5-12(19)15-13-16-17-14(21-13)20-11-8-6-10(7-9-11)18(2)3/h6-9H,4-5H2,1-3H3,(H,15,16,19)

Composition: C (52.15%), H (5.63%), N (17.38%), O (4.96%), S (19.89%)

Molar Mass: 322.45

Atom Count: 39

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	322.092203564
Formal Charge	0
FSP3	0.36
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	OTPXMEDQNCWPQX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	91.54
Topological Polar Surface Area	58.12
Polarizability	33.32
Ring Count	2
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C14H18N4OS2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00