(2RS)-2-(3,4-Dimethoxyphenyl)-5-((2-(3,4-dimethoxyphenyl)ethyl)(methyl)amino)-2-ethylpentanenitrile
기본 정보
- CAS
67018-83-1- 표준 SMILES
CCC(C#N)(CCCN(C)CCc1ccc(OC)c(OC)c1)c1ccc(OC)c(OC)c1- InChIKey
SGTNSNPWRIOYBX-UHFFFAOYSA-N- 분자식
- C26H36N2O4
- 평균 분자량
- 440.6 g/mol
- 단동위원소 질량
- 440.26750763
이름 및 식별자
- 우선 이름
- (2RS)-2-(3,4-Dimethoxyphenyl)-5-((2-(3,4-dimethoxyphenyl)ethyl)(methyl)amino)-2-ethylpentanenitrile
- IUPAC
- 2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-ethylpentanenitrile
- 영어명
- Verapamil Impurity H
- 분자식
- C26H36N2O4
- 분자량
- 440.58
이름 및 동의어
Desisopropyl ethyl verapamil67018-83-11VYK4J9OWUD-525D-525, (RS)-Benzeneacetonitrile, alpha-(3-((2-(3,4-dimethoxyphenyl)ethyl)methylamino)propyl)-alpha-ethyl-3,4-dimethoxy-(2RS)-2-(3,4-DIMETHOXYPHENYL)-5-((2-(3,4-DIMETHOXYPHENYL)ETHYL)(METHYL)AMINO)-2-ETHYLPENTANENITRILERefChem:1049912Verapamil EP Impurity H5-((3,4-Dimethoxyphenethyl)(methyl)amino)-2-(3,4-dimethoxyphenyl)-2-ethylpentanenitrile2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-ethylpentanenitrileVerapamil Impurity H
이름 더 보기
Verapamil Impurity 11Verapamil Impurity N12Verapamil EP Impurity H HClBenzeneacetonitrile, α-[3-[[2-(3,4-dimethoxyphenyl)ethyl]methylamino]propyl]-α-ethyl-3,4-dimethoxy-a-[3-[[2-(3,4-Dimethoxyphenyl)ethyl]methylamino]propyl]-alpha-ethyl-3,4-dimethoxy-benzeneacetonitrileVerapamil hydrochloride Imp. H (EP): (2RS)-2-(3,4-dimethoxyphenyl)-5-[[2-(3,4-dimethoxyphenyl)ethyl](methyl) amino]-2-ethylpentanenitrile
UNII-1VYK4J9OWUVerapamil hydrochloride impurity H [EP]CHEMBL3310611ID145566Q27252960VERAPAMIL HYDROCHLORIDE IMPURITY H [EP IMPURITY].ALPHA.-(3-((2-(3,4-DIMETHOXYPHENYL)ETHYL)METHYLAMINO)PROPYL)-.ALPHA.-ETHYL-3,4-DIMETHOXYBENZENEACETONITRILE2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-2-ethyl-pentanenitrile
데이터베이스 식별자
- CAS
67018-83-1- PubChem CID
- 57358013
- ChEMBL
CHEMBL3310611- UNII
- 1VYK4J9OWU
- Nikkaji
- J481.387A
물성
구조 계산 물성
- XLogP
- 3.4
- 극성 표면적
- 64 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 13
- 무거운 원자 수
- 32
- 형식 전하
- 0
- 복잡도
- 579
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