1-(piperidin-4-yl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one dihydrochloride

HCID 22293181CAS 781649-84-1

기본 정보

표준 SMILES
Cl.Cl.O=c1[nH]c2ncccc2n1C1CCNCC1
InChIKey
OHUCGNJZMRINKX-UHFFFAOYSA-N
분자식
C11H16Cl2N4O
평균 분자량
291.17 g/mol
단동위원소 질량
290.07011649

개요

See other relationships...

이름 및 식별자

우선 이름
1-(piperidin-4-yl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one dihydrochloride
IUPAC
1-piperidin-4-yl-3H-imidazo[4,5-b]pyridin-2-one;dihydrochloride

이름 및 동의어

1-(piperidin-4-yl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one dihydrochloride1-piperidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one dihydrochloride1-(piperidin-4-yl)-1H,2H,3H-imidazo(4,5-b)pyridin-2-one dihydrochloride1-Piperidin-4-yl-1,3-dihydroimidazo(4,5-b)pyridin-2-one dihydrochlorideRefChem:428316937-843-7781649-84-11-(Piperidin-4-yl)-1H-imidazo[4,5-b]pyridin-2(3H)-one dihydrochloride1-piperidin-4-yl-1,3-dihydro-imidazo[4,5-b]pyridin-2-one dihydrochlorideMFCD147051731-piperidin-4-yl-3H-imidazo[4,5-b]pyridin-2-one;dihydrochloride2-Oxo-1-(4-piperidinyl)-2,3-dihydro-1H-imidazo[4,5-b]pyridine dihydrochloride
이름 더 보기
1-(Piperidin-4-yl)-1H-imidazo[4,5-b]pyridin-2(3H)-one (Hydrochloride)OHUCGNJZMRINKX-UHFFFAOYSA-N1,3-Dihydro-1-(4-piperidinyl)-2H-imidazo[4,5-b]pyridin-2-one DihydrochlorideRimegepant Impurity 2 DiHClSCHEMBL438908orb3143748CHEMBL3498426SCHEMBL30007314

데이터베이스 식별자

CAS
781649-84-1
PubChem CID
22293181
DTXSID
DTXSID80624480
ChEMBL
CHEMBL3498426
EC Number
937-843-7

물성

구조 계산 물성

극성 표면적
57.3 Ų
수소 결합 공여자 수
4
수소 결합 수용자 수
3
회전 가능 결합 수
1
무거운 원자 수
18

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)

관련 반응

145건

연결된 노트

불러오는 중…