기본 정보
- CAS
95520-81-3- 표준 SMILES
COc1ccc(Cc2ncc(CN3CCN(c4ccccc4OC)CC3)c3cc(OC)c(OC)cc23)cc1OC- InChIKey
PWZXTLHDGIBNLG-UHFFFAOYSA-N- 분자식
- C32H37N3O5
- 평균 분자량
- 543.7 g/mol
- 단동위원소 질량
- 543.27332129
이름 및 식별자
- 우선 이름
- Elziverine
- IUPAC
- 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-4-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]isoquinoline
- 현지명
- 엘지베린
- 영어명
- Elziverine
- 분자식
- C32H37N3O5
- 분자량
- 543.65
이름 및 동의어
Elziverine95520-81-3ElziverinaElziverine [INN]ElziverinumElziverinum [Latin]Elziverina [Spanish]UNII-1I2BO467451I2BO46745DTXSID70241867Elziverinum (Latin)6,7-Dimethoxy-4-((4-(o-methoxyphenyl)-1-piperazinyl)methyl)-1-veratrylisoquinoline
이름 더 보기
엘지베린1-[(3,4-Dimethoxyphenyl)methyl]-6,7-dimethoxy-4-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]isoquinolineIsoquinoline, 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-4-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]-
6,7-dimethoxy-1-(3,4-dimethoxybenzyl)-4-((4-(2-methoxyphenyl)-1-piperazinyl)methyl)isoquinolineIsoquinoline, 1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-4-((4-(2-methoxyphenyl)-1-piperazinyl)methyl)-RefChem:136568DTXCID00164358Ro 22-48391-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-4-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]isoquinoline1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-4-{[4-(2-methoxyphenyl)piperazin-1-yl]methyl}isoquinoline6,7-dimethoxy-1-{(3,4-dimethoxyphenyl)methyl}-4-([4-(2-methoxyphenyl)-1-piperazinyl]methyl)isoquinoline
데이터베이스 식별자
- CAS
95520-81-3- PubChem CID
- 65839
- DTXSID
DTXSID70241867- ChEMBL
CHEMBL2104212- UNII
- 1I2BO46745
- Nikkaji
- J326.613C
물성
구조 계산 물성
- XLogP
- 5.3
- 극성 표면적
- 65.5 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 40
- 형식 전하
- 0
- 복잡도
- 752
물리화학적 성질
- 끓는 점
- 682.4 · 682.4±55.0 °C(Predicted)
- 밀도
- 1.187 · 1.187±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 6.6 · 6.60±0.40(Predicted)
화학 및 산업
공급사4 곳
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]
관련 반응
3건
화합물 노트
불러오는 중…