N-(4-bromophenyl)-2-(4-methylpiperazin-1-yl)-2-sulfanylideneacetamide

N-(4-bromophenyl)-2-(4-methylpiperazin-1-yl)-2-sulfanylideneacetamide

Formula: C13H16BrN3OS

SMILES: CN1CCN(CC1)C(=S)C(=O)NC1=CC=C(Br)C=C1

IUPAC: N-(4-bromophenyl)-2-(4-methylpiperazin-1-yl)-2-sulfanylideneacetamide

InChI: InChI=1S/C13H16BrN3OS/c1-16-6-8-17(9-7-16)13(19)12(18)15-11-4-2-10(14)3-5-11/h2-5H,6-9H2,1H3,(H,15,18)

Composition: C (45.62%), H (4.71%), Br (23.35%), N (12.28%), O (4.67%), S (9.37%)

Molar Mass: 342.26

Atom Count: 35

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	341.019746
Formal Charge	0
FSP3	0.38
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	VZRHEZSOEBDPOH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	86
Topological Polar Surface Area	35.58
Polarizability	32.53
Ring Count	2
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H16BrN3OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00