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기본 정보
- CAS
154325-76-5- 표준 SMILES
CCOC(=O)C(C)(C)Cc1c(SC(C)(C)C)c2cc(OC)ccc2n1Cc1ccc(Cl)cc1- InChIKey
JPXNJCVPJOZELR-UHFFFAOYSA-N- 분자식
- C27H34ClNO3S
- 평균 분자량
- 488.1 g/mol
- 단동위원소 질량
- 487.19479263
이름 및 식별자
- 우선 이름
- Ethyl 3-(3-(tert-butylthio)-1-(4-chlorobenzyl)-5-methoxy-1H-indol-2-yl)-2,2-dimethylpropanoate
- IUPAC
- ethyl 3-[3-tert-butylsulfanyl-1-[(4-chlorophenyl)methyl]-5-methoxyindol-2-yl]-2,2-dimethylpropanoate
- 영어명
- 1H-Indole-2-propanoic acid, 1-[(4-chlorophenyl)methyl]-3-[(1,1-dimethylethyl)thio]-5-methoxy-ethyl ester
- 분자식
- C27H34ClNO3S
- 분자량
- 488.08
이름 및 동의어
154325-76-5Ethyl 3-(3-(tert-butylthio)-1-(4-chlorobenzyl)-5-methoxy-1H-indol-2-yl)-2,2-dimethylpropanoateethyl 3-[3-(tert-butylsulfanyl)-1-[(4-chlorophenyl)methyl]-5-methoxy-1H-indol-2-yl]-2,2-dimethylpropanoateethyl 3-[3-tert-butylsulfanyl-1-[(4-chlorophenyl)methyl]-5-methoxyindol-2-yl]-2,2-dimethylpropanoate1H-Indole-2-propanoic acid, 1-[(4-chlorophenyl)methyl]-3-[(1,1-dimethylethyl)thio]-5-methoxy-ethyl ester1H-Indole-2-propanoic acid, 1-[(4-chlorophenyl)methyl]-3-[(1,1-dimethylethyl)thio]-5-methoxy-ethyl eC27H34ClNO3SJPXNJCVPJOZELR-UHFFFAOYSA-NEthyl 3-{3-(tert-butylsulfanyl)-1-[(4-chlorophenyl)methyl]-5-methoxy-1H-indol-2-yl}-2,2-dimethylpropanoateSCHEMBL169604SCHEMBL30181651DTXSID70601407
이름 더 보기
1-[(4-Chlorophenyl)methyl]-3-[(1,1-dimethylethyl)thio]-5-methoxy-α,α-dimethyl-1H-indole-2-propanoic acid ethyl ester1H-Indole-2-propanoic acid, 1-[(4-chlorophenyl)Methyl]-3-[(1,1-diMethylethyl)thio]-5-Methoxy-a,a-diMethyl-, ethyl ester
물성
구조 계산 물성보충 중
- XLogP
- 7.1
- 극성 표면적
- 65.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 33
- 형식 전하
- 0
- 복잡도
- 644
물리화학적 성질
- 끓는 점
- 601.5 · 601.5±55.0 °C(Predicted)
- 밀도
- 1.13 · 1.13
- 저장 조건
- 2 · 2-8°C, stored under nitrogen
화학 및 산업
공급사12 곳
四川星优天下医药科技有限公司18328380615 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
南京精瑞久安生物技术有限公司025-58196018 800028039 · [email protected]
台州南峰药物研究所[email protected] 13127117265 · [email protected]
淄博百极荣创医药科技有限公司0533-6092686 13371592196 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 18917919676 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
重庆卡兰医药有限公司[email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
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