4-nitro-N-[(2-phenyl-1,3-thiazol-5-yl)methyl]benzamide

4-nitro-N-[(2-phenyl-1,3-thiazol-5-yl)methyl]benzamide

Formula: C17H13N3O3S

SMILES: [O-][N+](=O)C1=CC=C(C=C1)C(=O)NCC1=CN=C(S1)C1=CC=CC=C1

IUPAC: 4-nitro-N-[(2-phenyl-1,3-thiazol-5-yl)methyl]benzamide

InChI: InChI=1S/C17H13N3O3S/c21-16(12-6-8-14(9-7-12)20(22)23)18-10-15-11-19-17(24-15)13-4-2-1-3-5-13/h1-9,11H,10H2,(H,18,21)

Composition: C (60.17%), H (3.86%), N (12.38%), O (14.14%), S (9.45%)

Molar Mass: 339.37

Atom Count: 37

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	339.067762465
Formal Charge	0
FSP3	0.06
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	KWLKJCOPWNZWHY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	101.06
Topological Polar Surface Area	85.13
Polarizability	34.52
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H13N3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00