4-cyano-N'-[(E)-[1-(3-cyano-4,5-dimethylthiophen-2-yl)-2,5-dimethylpyrrol-3-yl]methylidene]-2-fluorobenzohydrazide

4-cyano-N'-[(E)-[1-(3-cyano-4,5-dimethylthiophen-2-yl)-2,5-dimethylpyrrol-3-yl]methylidene]-2-fluorobenzohydrazide

Formula: C22H18FN5OS

SMILES: CC1=C(C)C(C#N)=C(S1)N1C(C)=CC(C=NNC(=O)C2=CC=C(C=C2F)C#N)=C1C

IUPAC: 4-cyano-N'-[(E)-[1-(3-cyano-4,5-dimethylthiophen-2-yl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene]-2-fluorobenzohydrazide

InChI: InChI=1S/C22H18FN5OS/c1-12-7-17(14(3)28(12)22-19(10-25)13(2)15(4)30-22)11-26-27-21(29)18-6-5-16(9-24)8-20(18)23/h5-8,11H,1-4H3,(H,27,29)/b26-11+

Composition: C (62.99%), H (4.33%), F (4.53%), N (16.70%), O (3.81%), S (7.64%)

Molar Mass: 419.48

Atom Count: 48

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	419.121609557
Formal Charge	0
FSP3	0.18
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	KMEYZWOSFVEWEL-KBKYJPHKSA-N
Lipinski's Rule of Five
Molar Refractivity	126.31
Topological Polar Surface Area	93.97
Polarizability	41.7
Ring Count	3
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H18FN5OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00