4-[(3-bromo-5-ethoxy-4-methoxyphenyl)(3-hydroxy-5-methyl-4H-pyrazol-4-yl)methyl]-5-methyl-4H-pyrazol-3-ol

4-[(3-bromo-5-ethoxy-4-methoxyphenyl)(3-hydroxy-5-methyl-4H-pyrazol-4-yl)methyl]-5-methyl-4H-pyrazol-3-ol

Formula: C18H21BrN4O4

SMILES: CCOC1=CC(=CC(Br)=C1OC)C(C1C(C)=NN=C1O)C1C(C)=NN=C1O

IUPAC: 4-[(3-bromo-5-ethoxy-4-methoxyphenyl)(3-hydroxy-5-methyl-4H-pyrazol-4-yl)methyl]-5-methyl-4H-pyrazol-3-ol

InChI: InChI=1/C18H21BrN4O4/c1-5-27-12-7-10(6-11(19)16(12)26-4)15(13-8(2)20-22-17(13)24)14-9(3)21-23-18(14)25/h6-7,13-15H,5H2,1-4H3,(H,22,24)(H,23,25)

Composition: C (49.44%), H (4.84%), Br (18.27%), N (12.81%), O (14.63%)

Molar Mass: 437.294

Atom Count: 48

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	436.074618
Formal Charge	0
FSP3	0.44
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	2
InChIKey	IZUAZKBAUOAZQQ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	103.37
Topological Polar Surface Area	108.36
Polarizability	39.06
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H21BrN4O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00