N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-nitrobenzamide

N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-nitrobenzamide

Formula: C20H13N3O3S

SMILES: [O-][N+](=O)C1=CC=C(C=C1)C(=O)NC1=CC=CC(=C1)C1=NC2=CC=CC=C2S1

IUPAC: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-nitrobenzamide

InChI: InChI=1S/C20H13N3O3S/c24-19(13-8-10-16(11-9-13)23(25)26)21-15-5-3-4-14(12-15)20-22-17-6-1-2-7-18(17)27-20/h1-12H,(H,21,24)

Composition: C (63.99%), H (3.49%), N (11.19%), O (12.79%), S (8.54%)

Molar Mass: 375.4

Atom Count: 40

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	375.067762465
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	ZXHQSKPJPXBQNB-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	114.08
Topological Polar Surface Area	85.13
Polarizability	40.36
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H13N3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00