기본 정보
- CAS
65749-37-3- 표준 SMILES
CCN(CCO)c1ccc(N=C2C(=O)N(c3c(Cl)cc(Cl)cc3Cl)N=C2NC(=O)c2cccc(NC(=O)COc3ccc(C(C)(C)CC)cc3C(C)(C)CC)c2)c(C)c1- InChIKey
WUCNFXSTEJBBSR-UHFFFAOYSA-N- 분자식
- C45H51Cl3N6O5
- 평균 분자량
- 862.3 g/mol
- 단동위원소 질량
- 860.298652
이름 및 식별자
- 우선 이름
- 3-[[2-[2,4-Bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4-[[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino]-4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]benzamide
- IUPAC
- 3-[[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]acetyl]amino]-N-[4-[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino-5-oxo-1-(2,4,6-trichlorophenyl)pyrazol-3-yl]benzamide
- 영어명
- 3-[[[2,4-bis (1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4-[[4-[ethyl(2-hydroxyethyl)amino]-2-methBenzamide 2-(2,4-di-tert-Pentylphenoxy)-3'-[[1-(2,4,6-trichlorophenyl)-4-[[4-[ethyl(2-hydroxyethyl) amino]-2-methylphenyl]imino]-5-oxo-2-pyrazolin-3-yl]carbamoyl]acetanilide
- 분자식
- C45H51Cl3N6O5
- 분자량
- 862.28
이름 및 동의어
65749-37-33-((2-(2,4-Bis(1,1-dimethylpropyl)phenoxy)acetyl)amino)-N-(4-((4-(ethyl(2-hydroxyethyl)amino)-2-methylphenyl)imino)-4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl)benzamide3-[[2-[2,4-Bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4-[[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino]-4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]benzamideRefChem:272876Benzamide, 3-(((2,4-bis(1,1-dimethylpropyl)phenoxy)acetyl)amino)-N-(4-((4-(ethyl(2-hydroxyethyl)amino)-2-methylphenyl)imino)-4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl)-Benzamide, 3-[[[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4-[[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino]-4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]-DTXSID2070348SCHEMBL13588276SCHEMBL13591807WUCNFXSTEJBBSR-UHFFFAOYSA-N(Z)-3-(2-(2,4-di-tert-pentylphenoxy)acetamido)-N-(4-((4-(ethyl(2-hydroxyethyl)amino)-2-methylphenyl)imino)-5-oxo-1-(2,4,6-trichlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl)benzamide
물성
구조 계산 물성
- XLogP
- 11.5
- 극성 표면적
- 136 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 16
- 무거운 원자 수
- 59
- 형식 전하
- 0
- 복잡도
- 1,500
물리화학적 성질
- EPA
- 3 · Benzamide, 3-[[[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4-[[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino]-4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]- (65749-37-3)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory InformationChemical: Benzamide, 3-[[[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4-[[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino]-4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]-
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing InformationBenzamide, 3-[[2-[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4-[[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino]-4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]-: ACTIVE
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