기본 정보
- CAS
35838-58-5- 표준 SMILES
CCOC(=O)c1cnc2c(cnn2CC)c1NN=C(C)C.Cl- InChIKey
GQJUGJHJUZSJLZ-UHFFFAOYSA-N- 분자식
- C14H20ClN5O2
- 평균 분자량
- 325.79 g/mol
- 단동위원소 질량
- 325.1305526
개요
See also: Etazolate (has active moiety).
이름 및 식별자
- 우선 이름
- Etazolate Hydrochloride
- IUPAC
- ethyl 1-ethyl-4-(2-propan-2-ylidenehydrazinyl)pyrazolo[3,4-b]pyridine-5-carboxylate;hydrochloride
- 영어명
- ETAZOLATE
- 분자식
- C14H18N5O2HCl
- 분자량
- 0
이름 및 동의어
Etazolate hydrochloride35838-58-5Etazolate HClSQ 20009DTXSID4045767NSC-1636117YO3254Y6BDTXCID2025767Hydrochloride, EtazolateRefChem:138000SQ20009636-859-9
이름 더 보기
Nsc163611Etazolate hydrochloride solid1-ethyl-4-[(1-methylethylidene)hydrazino]1h-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester hydrochloride1H-Pyrazolo[3,4-B]pyridine-5-carboxylic acid, 1-ethyl-4-[(1-methylethylidene)hydrazino]-, ethyl ester, monohydrochlorideSQ20009, 1-Ethyl-4-[(1-methylethylidene)hydrazino]1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester hydrochloride
SQ-20009Etazolate (hydrochloride)Etazolate hydrochloride [USAN]ethyl 1-ethyl-4-(2-propan-2-ylidenehydrazinyl)pyrazolo[3,4-b]pyridine-5-carboxylate;hydrochlorideNCGC00093857-01SQ 64442Ethyl 1-ethyl-4-(isopropylidenehydrazino)-1H-pyrazolo[3,4-b]pyridine-5-carboxylate monohydrochlorideEtazolate hydrochloride (USAN)
데이터베이스 식별자
- CAS
35838-58-5- PubChem CID
- 37274
- DTXSID
DTXSID4045767- ChEMBL
CHEMBL1256671- UNII
- 7YO3254Y6B
- EC Number
- 636-859-9
물성
구조 계산 물성
- 극성 표면적
- 81.4 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 22
- 형식 전하
- 0
- 복잡도
- 397
물리화학적 성질
- 녹는점
- 193 · 193-194 °C
- 저장 조건
- room temp
- 용해도
- 2 O: · H2O: >20mg/mL (용액은 새로 준비해야 합니다.)
- 물리적 상태
- 고체
- 색상
- 하얀색
- 수용성
- 2 O: · H2O: >20mg/mL (Solutions should be freshly prepared.)
- InChI
- 1S/C14H19N5O2.ClH/c1-5-19-13-10(8-16-19)12(18-17-9(3)4)11(7-15-13)14(20)21-6-2;/h7-8H,5-6H2,1-4H3,(H,15,18);1H
- InChIKey
- GQJUGJHJUZSJLZ-UHFFFAOYSA-N
- SMILES
- Cl.CCOC(=O)c1cnc2n(CC)ncc2c1N\N=C(\C)C
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
안전 데이터
- wgk
- 3
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
약리 정보
MeSH Pharmacological Classification
Compounds which inhibit or antagonize the biosynthesis or actions of phosphodiesterases.
Agents that control agitated psychotic behavior, alleviate acute psychotic states, reduce psychotic symptoms, and exert a quieting effect. They are used in SCHIZOPHRENIA; senile dementia; transient psychosis following surgery; or MYOCARDIAL INFARCTION; etc. These drugs are often referred to as neuroleptics alluding to the tendency to produce neurological side effects, but not all antipsychotics are likely to produce such effects. Many of these drugs may also be effective against nausea, emesis, and pruritus.
응용 분야
용도Etazolate Hydrochloride is an acyclic nucleotide phosphodiesterase 4 inhibitor, which also exhibits antidepressant-like activity in acute and chronic mouse and rat model of depression.
공급사12 곳
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
南通全益生物科技有限公司0513-66337626 18051384581 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
兰州安杰利生物化学科技有限公司0931-8235634 13321316780 · [email protected]
上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
BOC Sciences[email protected]
上海鼓臣生物技术有限公司021-34675735 19147740836 · [email protected]
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