기본 정보
- 표준 SMILES
Nc1cccc(-c2nn(C3CCCCO3)c3ccc(-c4ncn(C(c5ccccc5)(c5ccccc5)c5ccccc5)n4)cc23)c1- InChIKey
JCDUOXCDAPEHFI-UHFFFAOYSA-N- 분자식
- C39H34N6O
- 평균 분자량
- 602.7 g/mol
이름 및 식별자
- 우선 이름
- 3-(1-perhydro-2H-pyran-2-yl-5-[1-(triphenylmethyl)(1,2,4-triazol-3-yl)]-1H-indazol-3-yl}phenylamine
- IUPAC
- 3-[1-(oxan-2-yl)-5-(1-trityl-1,2,4-triazol-3-yl)indazol-3-yl]aniline
이름 및 동의어
3-(1-perhydro-2H-pyran-2-yl-5-[1-(triphenylmethyl)(1,2,4-triazol-3-yl)]-1H-indazol-3-yl}phenylamine3-{1-perhydro-2H-pyran-2-yl-5-[1-(triphenylmethyl)(1,2,4-triazol-3-yl))-1H-indazol-3-yl}phenylamine3-{1-perhydro-2H-pyran-2-yl-5-[1-(triphenylmethyl)(1,2,4-triazol-3-yl)]-1H-indazol-3-yl}phenylamineSCHEMBL5374181SCHEMBL5651015JCDUOXCDAPEHFI-UHFFFAOYSA-N3-{1-perhydro-2H-pyran-2-yl -5-[1-(triphenylmethyl)(1,2,4-triazol-3-yl)]-1H-indazol-3-yl}phenylamine3-{1-perhydro-2h-pyran-2-yl-5-[1 -(triphenylmethyl)(1,2,4-triazol-3-yl)]-1h-indazol-3-yl}phenylamine3-{1-perhydro-2H-pyran-2-yl-5-[1-(triphenylmethyl) (1,2,4-triazol-3-yl)]-1H-indazol-3-yl}phenylamine3-{1-perhydro-2H-pyran-2-yl-5-[1-(triphenylmethyl)(1,2,4- triazol-3-yl)]-1H-indazol-3-yl}phenylamine3-{1-perhydro-2h-pyran-2-yl-5-[1-(triphenylmethyl)(1,2,4-triazol-3-yl)]-1h-indazol-3-yl} phenylamine3-{1-perhydro-2H-pyran-2-yl-5-[1-(triphenylmethyl)(1,2,4-triazol-3-yl)]-1H-indazol-3-yl}phenyl Amine
이름 더 보기
3-{1-perhydro-2H-pyran-2-yl-5-[1-(triphenylmethyl)(1,2,4-triazol-3-yl)]-1H-indazole-3-yl}phenylamine3-{1-perhydro-2h-pyran-2-yl-5-[1-(triphenylmethyl)(1,2,4triazol-3-yl)]-1h-indazol-3-yl}phenylamine3-{1-perhydro-2h-pyran-2-yl-5-[l -(triphenylmethyl)(1,2,4-triazol-3-yl)]-1h-indazol-3-yl}phenylamine3-{1-perhydro-2h-pyran-2-yl-5[-1-(triphenylmethyl)(1,2,4-triazol-3-yl)]-1h-indazol-3-yl}phenylamine
데이터베이스 식별자
- PubChem CID
- 21101182
물성
구조 계산 물성
- XLogP
- 7.8
- 극성 표면적
- 83.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 46
- 형식 전하
- 0
- 복잡도
- 917
관련 반응
130건
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