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Lesopitron

HCID 60813
노트반응
기본 정보개요이름 및 식별자물성화학 및 산업관련 반응화합물 노트
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기본 정보

CAS
132449-46-8
표준 SMILES
Clc1cnn(CCCCN2CCN(c3ncccn3)CC2)c1
InChIKey
AHCPKWJUALHOPH-UHFFFAOYSA-N
분자식
C15H21ClN6
평균 분자량
320.82 g/mol
단동위원소 질량
320.1516224

개요

Lesopitron is an anxiolytic with pre- and post-synaptic 5-HT1A agonist activity, which is under development by Esteve.

이름 및 식별자

우선 이름
Lesopitron
IUPAC
2-[4-[4-(4-chloropyrazol-1-yl)butyl]piperazin-1-yl]pyrimidine
영어명
Lesopitron
분자식
C15H21ClN6
분자량
320.826

이름 및 동의어

Lesopitron132449-46-82-(4-(4-(4-chloro-1H-pyrazol-1-yl)butyl)piperazin-1-yl)pyrimidineH1CGM4755H2-(4-(4-(4-Chloropyrazol-1-yl)butyl)-1-piperazinyl)pyrimidineDTXSID401575872-(4-(4-(4-chloro-1-pyrazolyl)butyl)-1-piperazinyl)pyrimidine2-{4-[4-(4-chloro-1H-pyrazol-1-yl)butyl]piperazin-1-yl}pyrimidineE4424lesopitronumRefChem:152884DTXCID6080078
이름 더 보기
Lesopitron, 10 mM in DMSO
Lesopitron [INN]2-[4-[4-(4-chloropyrazol-1-yl)butyl]piperazin-1-yl]pyrimidineUNII-H1CGM4755HLESOPITRON [MI]SCHEMBL246589orb1702056CHEMBL2105051BDBM82365

데이터베이스 식별자

CAS
132449-46-8
PubChem CID
60813
DTXSID
DTXSID40157587
ChEMBL
CHEMBL2105051
UNII
H1CGM4755H
Nikkaji
J561.799E

물성

구조 계산 물성

XLogP
1.8
극성 표면적
50.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
5
회전 가능 결합 수
6
무거운 원자 수
22
형식 전하
0
복잡도
317

실험 및 물리화학적 성질

DrugsPharmaceuticals -> Listed in ZINC15

화학 및 산업

약리 정보

Pharmacodynamics · 1건

In phase I trials in healthy volunteers, lesopitron was well tolerated in single doses up to 50 mg, and up to 45 mg/day in repeated doses. Lesopitron has negligible effects on alpha-adrenergic and dopaminergic receptors, and was more potent than structurally-related 5-HT1A agonists in rat social interaction and marmoset anxiety models. It also countered benzodiazepine withdrawal-induced anxiety in rodents. The acute toxicity of lesopitron is low and it does not potentiate the effects of alcohol or barbiturates. Long-term usage led to reductions in plasma glucose, triglycerides, phospholipids and cholesterol.

Mechanism of Action · 1건

Lesopitron acts as a ligand for central serotonin 5-HT1A receptors. Lesopitron inhibits haloperidol-induced catalepsy that is the consequence of its action on 5-HT1A autoreceptors. The ability of lesopitron to induce 5-HT syndrome reflects post-synaptic 5-HT1A receptor activation and the reversion of 8-OHDPAT-induced 5-HT syndrome by lesopitron suggests a partial agonist effect on this receptor-type. Lesopitron induced a hypothermic effect due to the enhanced activation of post-synaptic 5-HT1A receptors. The agonist effect of lesopitron on 5-HT1A receptors and its marked hypothermic effect is an added value for this drug and a stimulus to the study of its possible neuroprotective action.

Biological Half-Life1.1 to 5.6 hours
Metabolism/MetabolitesHepatic, the main metabolite being 5-hydroxylesopitron.
Absorption, Distribution and ExcretionRapidly absorbed in patients, having a time to maximum concentration (Tmax) ranging from 0.5 to 1 hour. The absolute bioavailability of lesopitron in rats was about 10%, suggesting an important first-pass effect.

공급사8 곳

銳迪國際科技有限公司18024082417 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
上海药禾平生物医药科技有限公司57540919 13120888836 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]
上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]

관련 반응

2건
반응 기록 만들기
HRID 362778 반응식
HRID 362778반응물로uspto-grants-1999_02
HRID 1735495 반응식
HRID 1735495생성물로uspto-grants-1996_07

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