Pentanamide, N-[2-chloro-5-[(hexadecylsulfonyl)amino]phenyl]-2-[[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino]-4,4-dimethyl-3-oxo-
기본 정보
- CAS
66037-08-9- 표준 SMILES
CCCCCCCCCCCCCCCCS(=O)(=O)Nc1ccc(Cl)c(NC(=O)C(=Nc2ccc(N(CC)CCO)cc2C)C(=O)C(C)(C)C)c1- InChIKey
XBWGLHVUPICTPS-UHFFFAOYSA-N- 분자식
- C40H63ClN4O5S
- 평균 분자량
- 747.5 g/mol
- 단동위원소 질량
- 746.42077
이름 및 식별자
- 우선 이름
- Pentanamide, N-[2-chloro-5-[(hexadecylsulfonyl)amino]phenyl]-2-[[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino]-4,4-dimethyl-3-oxo-
- IUPAC
- N-[2-chloro-5-(hexadecylsulfonylamino)phenyl]-2-[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino-4,4-dimethyl-3-oxopentanamide
이름 및 동의어
Pentanamide, N-(2-chloro-5-((hexadecylsulfonyl)amino)phenyl)-2-((4-(ethyl(2-hydroxyethyl)amino)-2-methylphenyl)imino)-4,4-dimethyl-3-oxo-DTXSID3070383Pentanamide, N-[2-chloro-5-[(hexadecylsulfonyl)amino]phenyl]-2-[[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino]-4,4-dimethyl-3-oxo-RefChem:859880DTXCID104469966037-08-9SCHEMBL14264522XBWGLHVUPICTPS-UHFFFAOYSA-N(Z)-N-(2-chloro-5-(hexadecylsulfonamido)phenyl)-2-((4-(ethyl(2-hydroxyethyl)amino)-2-methylphenyl)imino)-4,4-dimethyl-3-oxopentanamideN-[2-CHLORO-5-(HEXADECANE-1-SULFONAMIDO)PHENYL]-2-({4-[ETHYL(2-HYDROXYETHYL)AMINO]-2-METHYLPHENYL}IMINO)-4,4-DIMETHYL-3-OXOPENTANAMIDE
데이터베이스 식별자
- CAS
66037-08-9- PubChem CID
- 6455242
- DTXSID
DTXSID3070383
물성
구조 계산 물성
- XLogP
- 12.2
- 극성 표면적
- 137 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 26
- 무거운 원자 수
- 51
- 형식 전하
- 0
- 복잡도
- 1,140
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
화학 및 산업
용도 및 제조
General Manufacturing InformationPentanamide, N-[2-chloro-5-[(hexadecylsulfonyl)amino]phenyl]-2-[[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino]-4,4-dimethyl-3-oxo-: ACTIVE
관련 반응
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