2-methyl-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitrobenzamide

2-methyl-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitrobenzamide

Formula: C22H17N3O4

SMILES: CC1=CC=C2OC(=NC2=C1)C1=CC=CC(NC(=O)C2=CC=CC(=C2C)[N+]([O-])=O)=C1

IUPAC: 2-methyl-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitrobenzamide

InChI: InChI=1S/C22H17N3O4/c1-13-9-10-20-18(11-13)24-22(29-20)15-5-3-6-16(12-15)23-21(26)17-7-4-8-19(14(17)2)25(27)28/h3-12H,1-2H3,(H,23,26)

Composition: C (68.21%), H (4.42%), N (10.85%), O (16.52%)

Molar Mass: 387.395

Atom Count: 46

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	387.121906039
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	USCSBWKYKSRJRW-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	119.76
Topological Polar Surface Area	98.27
Polarizability	42.09
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H17N3O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00