N-(1-(2,2-Difluoro-2-(4-(trifluoromethyl)phenyl)ethyl)piperidin-4-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
기본 정보
- CAS
913574-42-2- 표준 SMILES
FC(F)(F)c1ccc(C(F)(F)CN2CCC(Nc3ncnc4[nH]ncc34)CC2)cc1- InChIKey
GXJBVCKDEHELEL-UHFFFAOYSA-N- 분자식
- C19H19F5N6
- 평균 분자량
- 426.4 g/mol
- 단동위원소 질량
- 426.15913544
이름 및 식별자
- 우선 이름
- N-(1-(2,2-Difluoro-2-(4-(trifluoromethyl)phenyl)ethyl)piperidin-4-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
- IUPAC
- N-[1-[2,2-difluoro-2-[4-(trifluoromethyl)phenyl]ethyl]piperidin-4-yl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
- 영어명
- N-(1-(2,2-difluoro-2-(4-(trifluoromethyl)phenyl)ethyl)piperidin-4-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
- 분자식
- C19H19F5N6
- 분자량
- 426.39
이름 및 동의어
913574-42-2N-(1-(2,2-Difluoro-2-(4-(trifluoromethyl)phenyl)ethyl)piperidin-4-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amineCID 11959514N-[1-[2,2-difluoro-2-[4-(trifluoromethyl)phenyl]ethyl]piperidin-4-yl]-1H-pyrazolo[3,4-d]pyrimidin-4-amineN-[1-[2,2-Difluoro-2-[4-(trifluoromethyl)phenyl]ethyl]-4-piperidinyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amineN-(1-(2,2-Difluoro-2-(4-(trifluoromethyl);phenyl);ethyl);piperidin-4-yl);-1H-pyrazolo[3,4-d]pyrimidin-4-amineN-(1-(2,2-Difluoro-2-(4-(trifluoromethyl)phenyl)ethyl)-piperidin-4-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-aminen-(1-{2,2-difluoro-2-[4-(trifluoromethyl)phenyl]ethyl}piperidin-4-yl)-1h-pyrazolo[3,4-d]pyrimidin-4-amineNR2B-IN-1SCHEMBL4310737CHEMBL6006710DTXSID60474788
이름 더 보기
N-(1-(2,2-Difluoro-2-(4-(trifluoromethyl)N-(1-(2,2-difluoro-2-(4-(trifluoroMethyl)phenyl)ethyl)piperidin-N-(1-(2,2-Difluoro-2-(4-(trifluoromethyl)phenyl)ethyl)-piperidin-4-yl)-1H-pyrazolo[3,4-d]pyrimN-(1-(2,2-Difluoro-2-(4-(trifluoromethyl)phenyl)ethyl)-piperidin-4-yl)-1H-pyrazolo[3,4-d]pyrimidi1H-Pyrazolo[3,4-d]pyrimidin-4-amine, N-[1-[2,2-difluoro-2-[4-(trifluoromethyl)phenyl]ethyl]-4-piperidinyl]-{1-[2,2-Difluoro-2-(4-trifluoromethyl-phenyl)-ethyl]-piperidin-4-yl}-(1H-pyrazolo[3,4-d]pyrimidin-4-yl)-amine
GXJBVCKDEHELEL-UHFFFAOYSA-NBDBM280739GLXC-10490US10030026, Compound LX-1AKOS015999835EBC-4950771-{2,2-DIFLUORO-2-[4-(TRIFLUOROMETHYL)PHENYL]ETHYL}-N-{1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-YL}PIPERIDIN-4-AMINE
데이터베이스 식별자
- CAS
913574-42-2- PubChem CID
- 11959514
- DTXSID
DTXSID60474788- ChEMBL
CHEMBL6006710
물성
구조 계산 물성
- XLogP
- 4.1
- 극성 표면적
- 69.7 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 560
물리화학적 성질
- 밀도
- 1.43 · 1.430
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…