N-[5-(hydroxymethyl)-2-(4-methoxyphenyl)-1,3-dioxan-5-yl]-N'-phenylethanediamide

N-[5-(hydroxymethyl)-2-(4-methoxyphenyl)-1,3-dioxan-5-yl]-N'-phenylethanediamide

Formula: C20H22N2O6

SMILES: COC1=CC=C(C=C1)C1OCC(CO)(CO1)NC(=O)C(=O)NC1=CC=CC=C1

IUPAC: N-[5-(hydroxymethyl)-2-(4-methoxyphenyl)-1,3-dioxan-5-yl]-N'-phenylethanediamide

InChI: InChI=1S/C20H22N2O6/c1-26-16-9-7-14(8-10-16)19-27-12-20(11-23,13-28-19)22-18(25)17(24)21-15-5-3-2-4-6-15/h2-10,19,23H,11-13H2,1H3,(H,21,24)(H,22,25)

Composition: C (62.17%), H (5.74%), N (7.25%), O (24.84%)

Molar Mass: 386.404

Atom Count: 50

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	386.147786436
Formal Charge	0
FSP3	0.3
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
InChIKey	AECBDUWZOJRJHE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	101.22
Topological Polar Surface Area	106.12
Polarizability	39.06
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H22N2O6		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00