fpr A14

fpr A14

Formula: C23H20N2O5

SMILES: COC1=C(OCC2=CC=CC=C2)C=CC(C=NNC(=O)C2=CC3=C(OCO3)C=C2)=C1

IUPAC: N'-{[4-(benzyloxy)-3-methoxyphenyl]methylidene}-2H-1,3-benzodioxole-5-carbohydrazide

InChI: InChI=1S/C23H20N2O5/c1-27-21-11-17(7-9-19(21)28-14-16-5-3-2-4-6-16)13-24-25-23(26)18-8-10-20-22(12-18)30-15-29-20/h2-13H,14-15H2,1H3,(H,25,26)

Composition: C (68.31%), H (4.98%), N (6.93%), O (19.78%)

Molar Mass: 404.422

Atom Count: 50

Heavy Atom Count: 30

Properties

Properties

Common Names	fpr A14
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	404.137221752
Formal Charge	0
FSP3	0.13
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	ULOKADSYVZOTTL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	111.54
Topological Polar Surface Area	78.38
Polarizability	42.4
Ring Count	4
Rotatable Bond Count	7

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C23H20N2O5		Quote Only