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Doxapram Hydrochloride Hydrate

CAT: 0572-TRC-D552500-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D552500-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
7081-53-0
Synonyms
Doxapram hydrochloride; (4RS)-1-Ethyl-4-[2-(morpholin-4-yl)ethyl]-3,3-diphenylpyrrolidin-2-one hydrochloride; 2-Pyrrolidinone, 1-ethyl-4-[2-(4-morpholinyl)ethyl]-3,3-diphenyl-, hydrochloride, hydrate (1:1:1); 2-Pyrrolidinone, 1-ethyl-4-(2-morpholinoethyl)-3,3-diphenyl-, monohydrochloride, monohydrate (8CI); 2-Pyrrolidinone, 1-ethyl-4-[2-(4-morpholinyl)ethyl]-3,3-diphenyl-, monohydrochloride, monohydrate (9CI); 1-Ethyl-4-(2-morpholinoethyl)-3,3-diphenyl-2-pyrrolidinone hydrochloride hydrate; AHR 619; Doxapram hydrochloride hydrate; Doxapram hydrochloride monohydrate
Hazard Statement
Toxic if swallowed; UN number: UN2811; Packing Group: III
Purity
>95% (HPLC)
Smiles
O.Cl.CCN1CC(CCN2CCOCC2)C(C1=O)(c3ccccc3)c4ccccc4
Molecular Formula
C24 H30 N2 O2 . Cl H . H2 O
Molecular Weight
432.98
InChI
InChI=1S/C24H30N2O2.ClH.H2O/c1-2-26-19-22(13-14-25-15-17-28-18-16-25)24(23(26)27,20-9-5-3-6-10-20)21-11-7-4-8-12-21;;/h3-12,22H,2,13-19H2,1H3;1H;1H2
Additionnal Information
IUPAC name: 1-ethyl-4-(2-morpholin-4-ylethyl)-3,3-diphenylpyrrolidin-2-one;hydrate;hydrochloride
Shipping Conditions
Room Temperature
Storage Conditions
+20°C

Chemical Information

Doxapram Hydrochloride

Doxapram Hydrochloride is a peripheral and central respiratory stimulant with a brief duration of action. Doxapram hydrochloride stimulates respiration by an action on chemoreceptors in the carotid arteries and, at increased dosage, stimulates central respiratory centers in the medulla as well as other parts of the brain and spinal cord. This results in an increased tidal volume and a slightly increased respiratory rate. Doxapram hydrochloride may also improve cardiac output probably due to an increased release of catecholamines. This respiratory stimulant is used in postanesthesia respiratory depression.

CAS Number7081-53-0
PubChem CID64648
IUPAC Name1-ethyl-4-(2-morpholin-4-ylethyl)-3,3-diphenylpyrrolidin-2-one;hydrate;hydrochloride
Molecular FormulaC24H33ClN2O3
Molecular Weight433.0
Topological Polar Surface Area33.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count30
Formal Charge0
Complexity487
SMILES
CCN1CC(C(C1=O)(C2=CC=CC=C2)C3=CC=CC=C3)CCN4CCOCC4.O.Cl
InChI
InChI=1S/C24H30N2O2.ClH.H2O/c1-2-26-19-22(13-14-25-15-17-28-18-16-25)24(23(26)27,20-9-5-3-6-10-20)21-11-7-4-8-12-21;;/h3-12,22H,2,13-19H2,1H3;1H;1H2
InChIKey
ZOMBFZRWMLIDPX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Doxapram Hydrochloride
CAS: 7081-53-0
CID: 64648
Formula: C24H33ClN2O3
MW: 433.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight433.0
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass432.2179706
Monoisotopic Mass432.2179706
Topological Polar Surface Area33.8 Ų
Heavy Atom Count30
Formal Charge0
Complexity487
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
HY-B0551A-01Doxapram (hydrochloride hydrate)
T0038-01Doxapram hydrochloride hydrate
HY-B0551AR-01Doxapram (hydrochloride hydrate) (Standard)
GTR19275135-01Doxapram hydrochloride
HY-129146-01Doxapram (hydrochloride)
MBS3605716-01Doxapram hydrochloride monohydrate
CS-BU-00131Doxapram-d8 Hydrochloride
HY-129146S-01Doxapram-d5 (hydrochloride)
RM-D240107-01Doxapram Hydrochloride Impurity 7
RM-D240105-01Doxapram Hydrochloride Impurity 5

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