4-(oxolane-2-carbonyl)-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide

4-(oxolane-2-carbonyl)-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide

Formula: C16H22N4O4S2

SMILES: NS(=O)(=O)C1=CC=C(NC(=S)N2CCN(CC2)C(=O)C2CCCO2)C=C1

IUPAC: 4-(oxolane-2-carbonyl)-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide

InChI: InChI=1/C16H22N4O4S2/c17-26(22,23)13-5-3-12(4-6-13)18-16(25)20-9-7-19(8-10-20)15(21)14-2-1-11-24-14/h3-6,14H,1-2,7-11H2,(H,18,25)(H2,17,22,23)

Composition: C (48.23%), H (5.56%), N (14.06%), O (16.06%), S (16.09%)

Molar Mass: 398.5

Atom Count: 48

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	398.108247552
Formal Charge	0
FSP3	0.5
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	DOGBAXDKIPSWJS-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	103.6
Topological Polar Surface Area	104.97
Polarizability	40.22
Ring Count	3
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H22N4O4S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00