2-[(E)-{[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]imino}methyl]-6-methoxy-4-nitrophenol

2-[(E)-{[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]imino}methyl]-6-methoxy-4-nitrophenol

Formula: C21H14ClN3O5

SMILES: COC1=CC(=CC(C=NC2=CC=C(C=C2)C2=NC3=CC(Cl)=CC=C3O2)=C1O)[N+]([O-])=O

IUPAC: 2-[(E)-{[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]imino}methyl]-6-methoxy-4-nitrophenol

InChI: InChI=1S/C21H14ClN3O5/c1-29-19-10-16(25(27)28)8-13(20(19)26)11-23-15-5-2-12(3-6-15)21-24-17-9-14(22)4-7-18(17)30-21/h2-11,26H,1H3/b23-11+

Composition: C (59.52%), H (3.33%), Cl (8.36%), N (9.92%), O (18.88%)

Molar Mass: 423.81

Atom Count: 44

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	423.0621983
Formal Charge	0
FSP3	0.05
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	RPPKISBBBQKOQL-FOKLQQMPSA-N
Lipinski's Rule of Five
Molar Refractivity	122.72
Topological Polar Surface Area	110.99
Polarizability	43.1
Ring Count	4
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H14ClN3O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00