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Details

Stereochemistry RACEMIC
Molecular Formula 2C19H24N2O2.2C7H8O3S.H2O
Molecular Weight 987.231
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of XYLAMIDINE TOSYLATE HEMIHYDRATE

SMILES

O.CC1=CC=C(C=C1)S(O)(=O)=O.CC2=CC=C(C=C2)S(O)(=O)=O.COC3=CC=CC(OC(C)CNC(=N)CC4=CC=CC(C)=C4)=C3.COC5=CC=CC(OC(C)CNC(=N)CC6=CC=CC(C)=C6)=C5

InChI

InChIKey=FKFRSAWYMDRWMY-UHFFFAOYSA-N
InChI=1S/2C19H24N2O2.2C7H8O3S.H2O/c2*1-14-6-4-7-16(10-14)11-19(20)21-13-15(2)23-18-9-5-8-17(12-18)22-3;2*1-6-2-4-7(5-3-6)11(8,9)10;/h2*4-10,12,15H,11,13H2,1-3H3,(H2,20,21);2*2-5H,1H3,(H,8,9,10);1H2

HIDE SMILES / InChI
Molecular Formula H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula C7H8O3S
Molecular Weight 172.202
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula C19H24N2O2
Molecular Weight 312.4061
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Description

Xylamidine is a peripherally-restricted antagonist of 5HT2A and 5HT1A receptor. It is used to study the role of the serotonin receptors in the regulation of food intake, cardiovascular function, and regulation of body temperature.

Approval Year

Unknown
139594
PubMed

PubMed

TitleDatePubMed
Differential effects of nitroblue tetrazolium on the hemodynamic responses elicited by activation of alpha1-adrenoceptors and 5-HT2 receptors in conscious rats.
2006 Mar 27
5-HT activates vagal afferent cell bodies in vivo: role of 5-HT2 and 5-HT3 receptors.
2006 Nov 17
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:31:47 GMT 2023
Edited
by admin
on Fri Dec 15 16:31:47 GMT 2023
Record UNII
3Z1VNM4T7B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
XYLAMIDINE TOSYLATE HEMIHYDRATE
Common Name English
N-(2-(M-METHOXYPHENOXY)PROPYL)-2-M-TOLYLACETAMIDINE MONO-P-TOLUENESULFONATE HEMIHYDRATE
Common Name English
N-(2-(M-METHOXYPHENOXY)PROPYL)-2-M-TOLYLACETAMIDINE MONO-P-TOLUENESULPHONATE HEMIHYDRATE
Common Name English
XYLAMIDINE TOSILATE HEMIHYDRATE
Common Name English
BENZENEETHANIMIDAMIDE, N-(2-(3-METHOXYPHENOXY)PROPYL)-3-METHYL-, 4-METHYLBENZENESULFONATE, HYDRATE (2:2:1)
Systematic Name English
Code System Code Type Description
FDA UNII
3Z1VNM4T7B
Created by admin on Fri Dec 15 16:31:47 GMT 2023 , Edited by admin on Fri Dec 15 16:31:47 GMT 2023
PRIMARY
CAS
13717-05-0
Created by admin on Fri Dec 15 16:31:47 GMT 2023 , Edited by admin on Fri Dec 15 16:31:47 GMT 2023
PRIMARY
PUBCHEM
23725073
Created by admin on Fri Dec 15 16:31:47 GMT 2023 , Edited by admin on Fri Dec 15 16:31:47 GMT 2023
PRIMARY
Related Record Type Details
Structure of XYLAMIDINE TOSYLATE ANHYDROUS
ANHYDROUS->SOLVATE
Structure of XYLAMIDINE
PARENT -> SALT/SOLVATE
Related Record Type Details
Structure of XYLAMIDINE
ACTIVE MOIETY
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