2-(morpholin-4-yl)-5-{[(2,4,5-trimethoxyphenyl)methyl]amino}benzoic acid

2-(morpholin-4-yl)-5-{[(2,4,5-trimethoxyphenyl)methyl]amino}benzoic acid

Formula: C21H26N2O6

SMILES: COC1=CC(OC)=C(OC)C=C1CNC1=CC=C(N2CCOCC2)C(=C1)C(O)=O

IUPAC: 2-(morpholin-4-yl)-5-{[(2,4,5-trimethoxyphenyl)methyl]amino}benzoic acid

InChI: InChI=1S/C21H26N2O6/c1-26-18-12-20(28-3)19(27-2)10-14(18)13-22-15-4-5-17(16(11-15)21(24)25)23-6-8-29-9-7-23/h4-5,10-12,22H,6-9,13H2,1-3H3,(H,24,25)

Composition: C (62.67%), H (6.51%), N (6.96%), O (23.85%)

Molar Mass: 402.447

Atom Count: 55

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	402.179086565
Formal Charge	0
FSP3	0.38
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	2
InChIKey	IIBFJTOZWBKBIV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	111.01
Topological Polar Surface Area	89.49
Polarizability	41.3
Ring Count	3
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H26N2O6		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00