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Xamoterol

Xamoterol structure

CAS No:
81801-12-9
Formula:
C16H25N3O5
Chemical Name:
Xamoterol
Synonyms:
4-Morpholinecarboxamide,N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]-;4-Morpholinecarboxamide,N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]-,(±)-;N-[2-[[2-Hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]-4-morpholinecarboxamide;Xamoterol;69630-07-5;1805803-83-1
Categories:
Organic Chemistry > Amides

Description

Xamoterol is a member of morpholines.|Xamoterol is a β1-adrenoceptor partial agonist that has shown to improve systolic and diastolic function in studies with heart failure patients. It modulates the sympathetic control of the heart but has no agonist action on β2-adrenoceptors.|A phenoxypropanolamine derivative that is a selective beta-1-adrenergic agonist.

Xamoterol Basic Attributes

Molecular Weight：

455.461

Exact Mass：

339.39

EC Number：

277-319-9

DSSTox ID：

DTXSID8045222

ATC Code：

C - Cardiovascular system

Characteristics

PSA：

177.89000

XLogP3：

0.19480

Appearance：

white solid

Density：

1.265g/cm3

Boiling Point：

651.4ºC at 760 mmHg

Flash Point：

347.7ºC

Refractive Index：

1.571

Water Solubility：

H2O: 10 mg/mL at 60 °C, soluble

Safety Information

wgk germany：

safety instructions：

22-24/25

Precautionary statement(s)：

P201, P202, P281, P308+P313, P405, P501

Hazard Statements：

H361

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

Xamoterol Use and Manufacturing

Stimulant (cardiac).

Computed Properties

Molecular Weight:339.39
XLogP3:-0.6
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:339.17942091
Monoisotopic Mass:339.17942091
Topological Polar Surface Area:103
Heavy Atom Count:24
Complexity:358
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes