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4-Morpholinecarboxamide, N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]-, (E)-2-butenedioate (2:1)

4-Morpholinecarboxamide, N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]-, (E)-2-butenedioate (2:1) structure

CAS No:
73210-73-8
Formula:
C16H25N3O5.¹/2C4H4O4
Chemical Name:
4-Morpholinecarboxamide, N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]-, (E)-2-butenedioate (2:1)
Synonyms:
4-Morpholinecarboxamide,N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]-,(E)-2-butenedioate (2:1);4-Morpholinecarboxamide,N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]-,(E)-2-butenedioate (2:1) (salt);4-Morpholinecarboxamide,N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]-,(2E)-2-butenedioate (2:1) (salt);ICI 118587;Xamoterol hemifumarate;Corwin;Xamoterol fumarate;Carwin;Xamtol;90730-93-1
Categories:
Organic Chemistry > Amides

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Description

A phenoxypropanolamine derivative that is a selective beta-1-adrenergic agonist.

4-Morpholinecarboxamide, N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]-, (E)-2-butenedioate (2:1) Basic Attributes

Molecular Weight：

339.38700

Exact Mass：

794.36980042 g/mol

EC Number：

277-319-9

Characteristics

PSA：

103.29000

XLogP3：

0.48300

Appearance：

white solid

Melting Point：

168-169 °C (decomp)

Boiling Point：

651.4ºC

Flash Point：

347.7ºC

Storage Conditions：

Store at RT

Safety Information

safety instructions：

S22; S24/25

GHS Classification：

|Warning|H361 (100%): Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity]|P201, P202, P281, P308+P313, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Drug Information

MeSH：

Compounds that bind to and activate ADRENERGIC BETA-1 RECEPTORS. (See all compounds classified as Adrenergic beta-1 Receptor Agonists.)

MeSH Entry Terms：

Carwin

Computed Properties

Molecular Weight:794.8
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:18
Exact Mass:794.36980042
Monoisotopic Mass:794.36980042
Topological Polar Surface Area:281
Heavy Atom Count:56
Complexity:477
Undefined Atom Stereocenter Count:2
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

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Guide of 4-Morpholinecarboxamide, N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]-, (E)-2-butenedioate (2:1)

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
Latest News
Learn More Other Chemicals

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