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Clorgyline

HCID 4380
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GrundinformationenÜberblickNamen und BezeichnerEigenschaftenChemie und IndustrieZugehörige ReaktionenNotizen zur Verbindung
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Grundinformationen

CAS
17780-72-2
Standard-SMILES
C#CCN(C)CCCOc1ccc(Cl)cc1Cl
InChIKey
BTFHLQRNAMSNLC-UHFFFAOYSA-N
Summenformel
C13H15Cl2NO
Durchschnittliche Molmasse
272,17 g/mol
Monoisotopische Masse
271,0530695

Überblick

Clorgyline is an aromatic ether that is the 2,4-dichlorophenyl ether of 3-aminopropan-1-ol in which the nitrogen is substituted by a methyl group and a prop-1-yn-3-yl group. A monoamine oxidase inhibitor, it was formerly used as an antidepressant. It has a role as an antidepressant and an EC 1.4.3.4 (monoamine oxidase) inhibitor. It is a dichlorobenzene, an aromatic ether, a tertiary amino compound and a terminal acetylenic compound.

Namen und Bezeichner

Bevorzugter Name
Clorgyline
IUPAC
3-(2,4-dichlorophenoxy)-N-methyl-N-prop-2-ynylpropan-1-amine
Englischer Name
CLORGYLINE
Summenformel
C13H15Cl2NO
Molmasse
272.17

Namen und Synonyme

ClorgilineCLORGYLINE17780-72-2ChlorgylineClorgilinaClorgilinumM and B 9302M & B 9302N-(3-(2,4-Dichlorophenoxy)propyl)-N-methyl-2-propynylamineM&B 9302LYJ16FZU9QN-(3-(2,4-dichlorophenoxy)propyl)-N-methylprop-2-yn-1-amine
Weitere Namen anzeigen
N-[3-(2,4-Dichlorophenoxy)propyl]-N-methyl-2-propyn-1-aminem&b9302mandb9302n-(3-(2,4-dichlorophenoxy)propyl)-n-methyl-2-propynylaminn-(3-(2,4-dichlorophenoxy)propyl)-n-methyl-2-propyn-1-aminN-Methyl-N-[3-(2,4-dichlorophenoxy)propyl]-2-propyne-1-amine3-(2,4-dichlorophenoxy)-N-methyl-N-prop-2-ynylpropan-1-amine2-Propyn-1-aMine, N-[3-(2,4-dichlorophenoxy)propyl]-N-Methyl-
DTXSID3048445M&B-9302N-[3-(2,4-dichlorophenoxy)propyl]-N-methylprop-2-yn-1-amine2-Propyn-1-amine, N-(3-(2,4-dichlorophenoxy)propyl)-N-methyl-CHEBI:3763ClorgilinRefChem:127097DTXCID9028419

Datenbank-Bezeichner

Eigenschaften

Berechnete Struktureigenschaften

XLogP
4,2
Polarare Oberfläche (TPSA)
12,5 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
6
Schwere Atome
17
Formalladung
0
Komplexität
263

Experimentelle und physikochemische Eigenschaften

DrugsPharmaceuticals -> Listed in ZINC15
SpringerMaterials PropertiesChemical shift
Collision Cross Section156.1 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

Physikochemische Eigenschaften

Siedepunkt
361.3 · 361.3±37.0 °C(Predicted)
Dichte
1.196 · 1.196±0.06 g/cm3(Predicted)
pka
6.98 · 6.98±0.50(Predicted)
Aggregatzustand
Liquid
Farbe
Colorless to light yellow

Chemie und Industrie

Pharmakologische Informationen

MeSH Pharmacological Classification · 2 Einträge

Mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions. Several MONOAMINE OXIDASE INHIBITORS are useful as antidepressants apparently as a long-term consequence of their modulation of catecholamine levels. The tricyclic compounds useful as antidepressive agents (ANTIDEPRESSIVE AGENTS, TRICYCLIC) also appear to act through brain catecholamine systems. A third group (ANTIDEPRESSIVE AGENTS, SECOND-GENERATION) is a diverse group of drugs including some that act specifically on serotonergic systems.

A chemically heterogeneous group of drugs that have in common the ability to block oxidative deamination of naturally occurring monoamines. (From Gilman, et al., Goodman and Gilman's The Pharmacological Basis of Therapeutics, 8th ed, p414)

Anbieter16 Anbieter

Aladdin Scientific[email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
湖北魏氏化学试剂股份有限公司027-59102966 18717199209 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
南通全益生物科技有限公司0513-66337626 18051384581 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
风咏生物(AbMole)021-10000000 13000000000 · [email protected]

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Auf dieser SeiteGrundinformationenÜberblickNamen und BezeichnerEigenschaftenChemie und IndustrieZugehörige ReaktionenNotizen zur Verbindung
CAS
17780-72-2
PubChem CID
4380
DTXSID
DTXSID3048445
ChEMBL
CHEMBL8706
ChEBI
CHEBI:3763
UNII
LYJ16FZU9Q
Nikkaji
J10.191E
上海源叶生物科技有限公司18916372613 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
北京科易通达科技发展有限公司17743531240 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
Capot Chemical Co.,Ltd.+86-(0)57185586718 +86-13336195806 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]
苏州致信生物科技有限公司0512-65118909 18100677375 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]

Ergänzende Hinweise

DefinitionChEBI: An aromatic ether that is the 2,4-dichlorophenyl ether of 3-aminopropan-1-ol in which the nitrogen is substituted by a methyl group and a prop-1-yn-3-yl group. A monoamine oxidase inhibitor, it was formerly used as an antidepressant.