N-[3-(5-{[2-(2-chloro-5-nitrophenyl)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)phenyl]acetamide

N-[3-(5-{[2-(2-chloro-5-nitrophenyl)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)phenyl]acetamide

Formula: C18H13ClN4O5S

SMILES: CC(=O)NC1=CC=CC(=C1)C1=NN=C(O1)SCC(=O)C1=CC(=CC=C1Cl)[N+]([O-])=O

IUPAC: N-[3-(5-{[2-(2-chloro-5-nitrophenyl)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)phenyl]acetamide

InChI: InChI=1S/C18H13ClN4O5S/c1-10(24)20-12-4-2-3-11(7-12)17-21-22-18(28-17)29-9-16(25)14-8-13(23(26)27)5-6-15(14)19/h2-8H,9H2,1H3,(H,20,24)

Composition: C (49.95%), H (3.03%), Cl (8.19%), N (12.94%), O (18.48%), S (7.41%)

Molar Mass: 432.84

Atom Count: 42

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	432.0295184
Formal Charge	0
FSP3	0.11
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	HTVQJHUZCUMWNI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	120.35
Topological Polar Surface Area	128.23
Polarizability	40.89
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H13ClN4O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00