N-[1-(5-methyl-4-phenyl-1,2,4-triazol-3-yl)-2-phenyl-ethyl]-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]acetamide

HCID 90281210
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기본 정보

표준 SMILES
Cc1nnc(C(Cc2ccccc2)NC(=O)Cn2nc(C(F)(F)F)c3c2CCCC3)n1-c1ccccc1
InChIKey
HLWANMFOYIKKSV-UHFFFAOYSA-N
분자식
C27H27F3N6O
평균 분자량
508.5 g/mol

이름 및 식별자

우선 이름
N-[1-(5-methyl-4-phenyl-1,2,4-triazol-3-yl)-2-phenyl-ethyl]-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]acetamide
IUPAC
N-[1-(5-methyl-4-phenyl-1,2,4-triazol-3-yl)-2-phenylethyl]-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]acetamide

이름 및 동의어

N-[1-(5-methyl-4-phenyl-1,2,4-triazol-3-yl)-2-phenyl-ethyl]-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]acetamideSCHEMBL15875169N-(1-(5-methyl-4-phenyl-4H-1,2,4-triazol-3-yl)-2-phenylethyl)-2-(3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl)acetamide

데이터베이스 식별자

PubChem CID
90281210

물성

구조 계산 물성

XLogP
4.9
극성 표면적
77.6 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
7
회전 가능 결합 수
7
무거운 원자 수
37

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