methyl 5-[(2H-1,3-benzodioxol-5-ylmethyl)amino]-2-(morpholin-4-yl)benzoate

methyl 5-[(2H-1,3-benzodioxol-5-ylmethyl)amino]-2-(morpholin-4-yl)benzoate

Formula: C20H22N2O5

SMILES: COC(=O)C1=CC(NCC2=CC=C3OCOC3=C2)=CC=C1N1CCOCC1

IUPAC: methyl 5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-(morpholin-4-yl)benzoate

InChI: InChI=1S/C20H22N2O5/c1-24-20(23)16-11-15(3-4-17(16)22-6-8-25-9-7-22)21-12-14-2-5-18-19(10-14)27-13-26-18/h2-5,10-11,21H,6-9,12-13H2,1H3

Composition: C (64.85%), H (5.99%), N (7.56%), O (21.60%)

Molar Mass: 370.405

Atom Count: 49

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	370.152871816
Formal Charge	0
FSP3	0.35
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	XYNHSYFNMAMSBH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	102.16
Topological Polar Surface Area	69.26
Polarizability	38.28
Ring Count	4
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H22N2O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00