N-[4-chloro-3-(trifluoromethyl)phenyl]-1-{N'-[(E)-(3,4-dihydroxyphenyl)methylidene]hydrazinecarbonyl}formamide

N-[4-chloro-3-(trifluoromethyl)phenyl]-1-{N'-[(E)-(3,4-dihydroxyphenyl)methylidene]hydrazinecarbonyl}formamide

Formula: C16H11ClF3N3O4

SMILES: OC1=CC=C(C=NNC(=O)C(=O)NC2=CC=C(Cl)C(=C2)C(F)(F)F)C=C1O

IUPAC: N-[4-chloro-3-(trifluoromethyl)phenyl]-1-{N'-[(E)-(3,4-dihydroxyphenyl)methylidene]hydrazinecarbonyl}formamide

InChI: InChI=1S/C16H11ClF3N3O4/c17-11-3-2-9(6-10(11)16(18,19)20)22-14(26)15(27)23-21-7-8-1-4-12(24)13(25)5-8/h1-7,24-25H,(H,22,26)(H,23,27)/b21-7+

Composition: C (47.84%), H (2.76%), Cl (8.82%), F (14.19%), N (10.46%), O (15.93%)

Molar Mass: 401.73

Atom Count: 38

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	401.039018
Formal Charge	0
FSP3	0.06
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	4
InChIKey	WOWNSEQWMVSKPT-QPSGOUHRSA-N
Lipinski's Rule of Five	1
Molar Refractivity	92.38
Topological Polar Surface Area	111.02
Polarizability	33.08
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H11ClF3N3O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00