N'-[(E)-{4-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]-3-methoxyphenyl}methylidene]-3-(2,5-dimethylpyrrol-1-yl)benzohydrazide

N'-[(E)-{4-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]-3-methoxyphenyl}methylidene]-3-(2,5-dimethylpyrrol-1-yl)benzohydrazide

Formula: C25H21ClFN5O3

SMILES: COC1=CC(C=NNC(=O)C2=CC=CC(=C2)N2C(C)=CC=C2C)=CC=C1OC1=NC(Cl)=NC=C1F

IUPAC: N'-[(E)-{4-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]-3-methoxyphenyl}methylidene]-3-(2,5-dimethyl-1H-pyrrol-1-yl)benzohydrazide

InChI: InChI=1S/C25H21ClFN5O3/c1-15-7-8-16(2)32(15)19-6-4-5-18(12-19)23(33)31-29-13-17-9-10-21(22(11-17)34-3)35-24-20(27)14-28-25(26)30-24/h4-14H,1-3H3,(H,31,33)/b29-13+

Composition: C (60.79%), H (4.29%), Cl (7.18%), F (3.85%), N (14.18%), O (9.72%)

Molar Mass: 493.92

Atom Count: 56

Heavy Atom Count: 35

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	493.1316954
Formal Charge	0
FSP3	0.12
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	CPEVHSHWSBUFOY-VFLNYLIXSA-N
Lipinski's Rule of Five
Molar Refractivity	143.68
Topological Polar Surface Area	90.63
Polarizability	49.57
Ring Count	4
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H21ClFN5O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00