4-[5-(3,5-Dichlorophenyl)-5-trifluoromethyl-4,5-dihydroisoxazol-3-yl]-2-methyl-N-methyl-N-(2-tetrahydrothienyl)benzoic acid amide

HCID 66784388

기본 정보

표준 SMILES
Cc1cc(C2=NOC(c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)ccc1C(=O)N(C)C1CCCS1
InChIKey
FBCASCOURJIASQ-UHFFFAOYSA-N
분자식
C23H21Cl2F3N2O2S
평균 분자량
517.4 g/mol

이름 및 식별자

우선 이름
4-[5-(3,5-Dichlorophenyl)-5-trifluoromethyl-4,5-dihydroisoxazol-3-yl]-2-methyl-N-methyl-N-(2-tetrahydrothienyl)benzoic acid amide
IUPAC
4-[5-(3,5-dichlorophenyl)-5-(trifluoromethyl)-4H-1,2-oxazol-3-yl]-N,2-dimethyl-N-(thiolan-2-yl)benzamide

이름 및 동의어

4-[5-(3,5-Dichlorophenyl)-5-trifluoromethyl-4,5-dihydroisoxazol-3-yl]-2-methyl-N-methyl-N-(2-tetrahydrothienyl)benzoic acid amideSCHEMBL7385994-[5-(3,5-Dichlorophenyl)-5-trifluoromethyl-4,5-dihydroisoxazole-3-yl]-2-methyl-N-methyl-N-(2-tetrahydrothienyl)benzoic acid amide

데이터베이스 식별자

PubChem CID
66784388

물성

구조 계산 물성

XLogP
6.6
극성 표면적
67.2 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
7
회전 가능 결합 수
4
무거운 원자 수
33

관련 반응

4건

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