N-[4-(1,3-benzoxazol-2-yl)-3-hydroxyphenyl]-4-methyl-3-nitrobenzamide

N-[4-(1,3-benzoxazol-2-yl)-3-hydroxyphenyl]-4-methyl-3-nitrobenzamide

Formula: C21H15N3O5

SMILES: CC1=CC=C(C=C1[N+]([O-])=O)C(=O)NC1=CC=C(C2=NC3=CC=CC=C3O2)C(O)=C1

IUPAC: N-[4-(1,3-benzoxazol-2-yl)-3-hydroxyphenyl]-4-methyl-3-nitrobenzamide

InChI: InChI=1S/C21H15N3O5/c1-12-6-7-13(10-17(12)24(27)28)20(26)22-14-8-9-15(18(25)11-14)21-23-16-4-2-3-5-19(16)29-21/h2-11,25H,1H3,(H,22,26)

Composition: C (64.78%), H (3.88%), N (10.79%), O (20.54%)

Molar Mass: 389.367

Atom Count: 44

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	389.101170595
Formal Charge	0
FSP3	0.05
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	XTBYLFRXRANPCA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	116.7
Topological Polar Surface Area	118.5
Polarizability	40.94
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H15N3O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00