CAS 478081-98-0 Isozaleplon (HCID 9879548)

기본 정보

CAS: 478081-98-0
표준 SMILES: CCN(C(C)=O)c1cccc(-c2ccn3ncc(C#N)c3n2)c1
InChIKey: ZMUMYMWAIXXLIY-UHFFFAOYSA-N
분자식: C17H15N5O
평균 분자량: 305.33 g/mol
단동위원소 질량: 305.1276601

이름 및 식별자

우선 이름: Isozaleplon
IUPAC: N-[3-(3-cyanopyrazolo[1,5-a]pyrimidin-5-yl)phenyl]-N-ethylacetamide
영어명: N-[3-(3-cyanopyrazolo[1,5-a]pyrimidin-5-yl)phenyl]-N-ethylacetamide
분자식: C17H15N5O
분자량: 305.33

이름 및 동의어

Isozaleplon478081-98-0N-(3-(3-Cyanopyrazolo[1,5-a]pyrimidin-5-yl)phenyl)-N-ethylacetamiden-[3-(3-cyanopyrazolo[1,5-a]pyrimidin-5-yl)phenyl]-n-ethylacetamideUNII-YP251266R0YP251266R0N-(3-(3-Cyanopyrazolo[1,5-alpha]pyrimidin-5-yl)phenyl)-N-ethylacetamideDTXSID50197297N-(3-(3-Cyanopyrazolo(1,5-a)pyrimidin-5-yl)phenyl)-N-ethylacetamideN-(3-(3-Cyanopyrazolo(1,5-alpha)pyrimidin-5-yl)phenyl)-N-ethylacetamideN-(3-{3-CYANOPYRAZOLO[1,5-A]PYRIMIDIN-5-YL}PHENYL)-N-ETHYLACETAMIDEN-(3-(3-CYANOPYRAZOLO(1,5-.ALPHA.)PYRIMIDIN-5-YL)PHENYL)-N-ETHYLACETAMIDE

이름 더 보기

Zaleplon USP Related Compound BN-(3-(3-Cyanopyrazolo[1,5-α]pyrimidin-5-yl)phenyl)-N-ethylacetamideN-(3-(3-Cyanopyrazolo[1,5-±]pyrimidin-5-yl)phenyl)-N-ethylacetamideAcetamide, N-[3-(3-cyanopyrazolo[1,5-a]pyrimidin-5-yl)phenyl]-N-ethyl-

RefChem:150170DTXCID60119788N-[3-(3-cyanopyrazolo[1,5-a]pyrimidin-5-yl)phenyl]-N-ethyl-acetamide7-(N-Ethylacetamidophenyl)-5-(N-ethylacetamidophenyl) ZaleplonAcetamide, N-[3-(3-cyanopyrazolo[1,5-a]pyrimidin-5-yl)phenyl]-N-ethyl-; N-[3-(3-Cyanopyrazolo[1,5-a]pyrimidin-5-yl)phenyl]-N-ethylacetamide; Zaleplon RC B CIV (USP); Zaleplon Related Compound BZaleplon Impurity 17SCHEMBL3162849ZMUMYMWAIXXLIY-UHFFFAOYSA-N

데이터베이스 식별자

CAS: 478081-98-0
PubChem CID: 9879548
DTXSID: DTXSID50197297
UNII: YP251266R0
Nikkaji: J2.815.515H

물성

구조 계산 물성

XLogP: 1
극성 표면적: 74.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 3
무거운 원자 수: 23
형식 전하: 0
복잡도: 487

물리화학적 성질

녹는점: 203 · 203-205 °C
밀도: 1.25 · 1.25±0.1 g/cm3(Predicted)
산도 계수 (pKa): -1.4 · -1.40±0.50(Predicted)

안전 및 규제

안전 데이터

HS 번호: 9999999999

화학 및 산업

응용 분야 · 1건

용도(N-[3-(3-Cyanopyrazolo[1,5-alpha]pyrimidin-5-yl)phenyl]-N-ethylacetamide) is used in the synthesis of Zaleplon (Z145000), which is a selective non-benzodiazepine GABAA receptor agonist, and a sedative-hypnotic, almost entirely used for the management/treatment of insomnia.

공급사5 곳

艾吉析科技（上海）有限公司17717235263 · [email protected]

上海维亦特生物科技有限公司15317051735 · [email protected]

深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]

上海贝万塔生物科技有限公司021-67187366 19901745723 · [email protected]

南京世洲生物科技有限公司17301488900 · [email protected]

화합물 노트

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