N-(2-{[2-Hydroxy-3-(4-hydroxyphenoxy)propyl]amino}ethyl)-4-morpholinecarboxamide
[CAS 69630-22-4]

Identification

• Name: N-(2-{[2-Hydroxy-3-(4-hydroxyphenoxy)propyl]amino}ethyl)-4-morpholinecarboxamide
• Synonyms: 0.5 Oxalate; bis[N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide] fumarate; Morpholine-4-carboxylic acid {2-[2-hydroxy-3-(4-hydroxy-phenoxy)-propylamino]-ethyl}-amide
• Molecular Formula: C₁₆H₂₅N₃O₅
• Molecular Weight: 339.39
• CAS Registry Number: 69630-22-4
• SMILES: C1COCCN1C(=O)NCCNCC(COC2=CC=C(C=C2)O)O
• InChI: 1S/C16H25N3O5/c20-13-1-3-15(4-2-13)24-12-14(21)11-17-5-6-18-16(22)19-7-9-23-10-8-19/h1-4,14,17,20-21H,5-12H2,(H,18,22)
• InChIKey: DXPOSRCHIDYWHW-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 651.4±55.0°C at 760 mmHg (Cal.)
• Flash point: 347.7±31.5°C (Cal.)

References

• (1): Zhao YH, Abraham MH, Le J, Hersey A, Luscombe CN, Beck G, Sherborne B, and Cooper I. Rate-limited Steps of Human Oral Absorption and QSAR Studies, Pharm Res., 2002, 19(10), 1446-57
• (2): Jayaprakash Pagadala, Kimberly Williams-Guy, Mohammed M. NoohCurrent address: Department of Biochemistry, Faculty of Pharmacy, Cairo University, Cairo 11562, Egypt, Jena J. Steinle and Duane D. Miller. Beta-adrenergic receptor signaling by the isomers of isoproterenol and like drugs in retinal endothelial cells and Müller cells, Med. Chem. Commun., 2011, 2, 726.