3-Imidazo[1,2-a]pyridin-3-yl-4-[10-(piperidine-1-carbonyl)-1,10-diazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraen-3-yl]pyrrole-2,5-dione
기본 정보
- CAS
603281-60-3- 표준 SMILES
O=C1NC(=O)C(c2cnc3ccccn23)=C1c1cn2c3c(cccc13)CN(C(=O)N1CCCCC1)CC2- InChIKey
HHSIUHRARDLCPM-UHFFFAOYSA-N- 분자식
- C28H26N6O3
- 평균 분자량
- 494.5 g/mol
- 단동위원소 질량
- 494.20663871
이름 및 식별자
- 우선 이름
- 3-Imidazo[1,2-a]pyridin-3-yl-4-[10-(piperidine-1-carbonyl)-1,10-diazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraen-3-yl]pyrrole-2,5-dione
- IUPAC
- 3-imidazo[1,2-a]pyridin-3-yl-4-[10-(piperidine-1-carbonyl)-1,10-diazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraen-3-yl]pyrrole-2,5-dione
- 영어명
- 3-IMidazo[1,2-a]pyridin-3-yl-4-[1,2,3,4-tetrahydro-2-(1-piperidinylcarbonyl)pyrrolo[3,2,1-jk][1,4]benzodiazepin-7-yl]-1H-pyrrole-2,5-dione
- 분자식
- C28H26N6O3
- 분자량
- 494.54
이름 및 동의어
603281-60-3CHEMBL3625883-Imidazo[1,2-a]pyridin-3-yl-4-[10-(piperidine-1-carbonyl)-1,10-diazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraen-3-yl]pyrrole-2,5-dione3-(Imidazo[1,2-a]pyridin-3-yl)-4-(2-(piperidine-1-carbonyl)-1,2,3,4-tetrahydro-[1,4]diazepino[6,7,1-hi]indol-7-yl)-1H-pyrrole-2,5-dioneSCHEMBL19075511DTXSID20461492BDBM50150702DB-2286603-(Imidazo[1,2-a]pyridin-3-yl)-4-[2-(piperidine-1-carbonyl)-1,2,3,4-tetrahydro[1,4]diazepino[6,7,1-hi]indol-7-yl]-1H-pyrrole-2,5-dione3-Imidazo[1,2-a]pyridin-3-yl-4-[2-(piperidine-1-carbonyl)-1,2,3,4-tetrahydro-[1,4]diazepino[6,7,1-hi]indol-7-yl]-pyrrole-2,5-dione3-Imidazo[1,2-alpha]pyridin-3-yl-4-[1,2,3,4-tetrahydro-2-(1-piperidinylcarbonyl)pyrrolo[3,2,1-jk][1,4]benzodiazepin-7-yl]-1H-pyrrole-2,5-dioneHHSIUHRARDLCPM-UHFFFAOYSA-N
이름 더 보기
3-IMidazo[1,2-a]pyridin-3-yl-4-[1,2,3,4-tetrahydro-2-(1-piperidinylcarbonyl)pyrrolo[3,2,1-jk][1,4]benzodiazepin-7-yl]-1H-pyrrole-2,5-dione
물성
구조 계산 물성
- XLogP
- 2.4
- 극성 표면적
- 92 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 37
- 형식 전하
- 0
- 복잡도
- 992
물리화학적 성질
- 밀도
- 1.5 · 1.50±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 7.58 · 7.58±0.60(Predicted)
화학 및 산업
응용 분야
용도3-Imidazo[1,2-a]pyridin-3-yl-4-[1,2,3,4-tetrahydro-2-(1-piperidinylcarbonyl)pyrrolo[3,2,1-jk][1,4]benzodiazepin-7-yl]-1H-pyrrole-2,5-dione is a newly developed potent and selective biarylmaleimide GSK3 inhibitor which may be effective in lowering plasma glucose in type 2 diabetes.
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