4-[(3,4-diethoxy-5-iodophenyl)(3-hydroxy-5-methyl-4H-pyrazol-4-yl)methyl]-5-methyl-4H-pyrazol-3-ol

4-[(3,4-diethoxy-5-iodophenyl)(3-hydroxy-5-methyl-4H-pyrazol-4-yl)methyl]-5-methyl-4H-pyrazol-3-ol

Formula: C19H23IN4O4

SMILES: CCOC1=CC(=CC(I)=C1OCC)C(C1C(C)=NN=C1O)C1C(C)=NN=C1O

IUPAC: 4-[(3,4-diethoxy-5-iodophenyl)(3-hydroxy-5-methyl-4H-pyrazol-4-yl)methyl]-5-methyl-4H-pyrazol-3-ol

InChI: InChI=1/C19H23IN4O4/c1-5-27-13-8-11(7-12(20)17(13)28-6-2)16(14-9(3)21-23-18(14)25)15-10(4)22-24-19(15)26/h7-8,14-16H,5-6H2,1-4H3,(H,23,25)(H,24,26)

Composition: C (45.80%), H (4.65%), I (25.47%), N (11.24%), O (12.84%)

Molar Mass: 498.321

Atom Count: 51

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	498.0764
Formal Charge	0
FSP3	0.47
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	2
InChIKey	YLKHLOGHAIEHLK-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	113.86
Topological Polar Surface Area	108.36
Polarizability	43.23
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H23IN4O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00