6-((3S,4S)-4-methylpyrrolidin-3-yl)-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one hydrochloride
기본 정보
- CAS
1082745-60-5- 표준 SMILES
C[C@@H]1CNC[C@H]1c1nc2c(cnn2C2CCOCC2)c(=O)[nH]1.Cl- InChIKey
JLEAXTVMNIFIAX-FOKYBFFNSA-N- 분자식
- C15H22ClN5O2
- 평균 분자량
- 339.82 g/mol
이름 및 식별자
- 우선 이름
- 6-((3S,4S)-4-methylpyrrolidin-3-yl)-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one hydrochloride
- IUPAC
- 6-[(3S,4S)-4-methylpyrrolidin-3-yl]-1-(oxan-4-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;hydrochloride
- 영어명
- 6-((3S,4S)-4-Methylpyrrolidin-3-yl)-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-d]pyriMidin-4(5H)-one hydrochloride (1:x)
- 분자식
- C15H22ClN5O2
- 분자량
- 339.82
이름 및 동의어
6-((3S,4S)-4-methylpyrrolidin-3-yl)-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one hydrochloride2070009-51-51082745-60-56-((3S,4S)-4-Methylpyrrolidin-3-yl)-1-(tetrahydro-2H-pyran-4-yl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one hydrochloride6-[(3S,4S)-4-methylpyrrolidin-3-yl]-1-(oxan-4-yl)-5H-pyrazolo[3,4-d]pyrimidin-4-one;hydrochlorideSCHEMBL1717433JLEAXTVMNIFIAX-FOKYBFFNSA-NCS-W0002484H-Pyrazolo[3,4-d]pyrimidin-4-one, 1,5-dihydro-6-[(3S,4S)-4-methyl-3-pyrrolidinyl]-1-(tetrahydro-2H-pyran-4-yl)-, hydrochloride (1:x)D77568E82907F986760
이름 더 보기
6-((3S,4S)-4-Methylpyrrolidin-3-yl)-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-d]pyriMidin-4(5H)-one hydrochloride (1:x)
6-[(3S,4S)-4-methylpyrrolidin-3-yl]-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one hydrogen chlorideRel-6-((3S,4S)-4-methylpyrrolidin-3-yl)-1-(tetrahydro-2H-pyran-4-yl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one hydrochlorideREL-6-((3S,4S)-4-METHYLPYRROLIDIN-3-YL)-1-(TETRAHYDRO-2H-PYRAN-4-YL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4(5H)-ONE HYDROCHLORIDErel-6-((3S,4S)-4-methylpyrrolidin-3-yl)-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one hydrochloride (1:x)
데이터베이스 식별자
- CAS
1082745-60-5- PubChem CID
- 136346626
물성
구조 계산 물성
- 극성 표면적
- 80.5 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 23
- 형식 전하
- 0
- 복잡도
- 477
관련 반응
2건
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