(E)-3-{1-[4-({[2-(tert-Butyl-dimethyl-silanyloxy)-ethyl]-[2-(1H-indol-3-yl)-ethyl]-amino}-methyl)-benzenesulfonyl]-1H-pyrrol-3-yl}-acrylic acid tert-butyl ester

HCID 66646255

기본 정보

표준 SMILES
CC(C)(C)OC(=O)/C=C/c1ccn(S(=O)(=O)c2ccc(CN(CCO[Si](C)(C)C(C)(C)C)CCc3c[nH]c4ccccc34)cc2)c1
InChIKey
RQWQQFCIPBAZHZ-OBGWFSINSA-N
분자식
C36H49N3O5SSi
평균 분자량
663.9 g/mol
단동위원소 질량
663.31621938

이름 및 식별자

우선 이름
(E)-3-{1-[4-({[2-(tert-Butyl-dimethyl-silanyloxy)-ethyl]-[2-(1H-indol-3-yl)-ethyl]-amino}-methyl)-benzenesulfonyl]-1H-pyrrol-3-yl}-acrylic acid tert-butyl ester
IUPAC
tert-butyl (E)-3-[1-[4-[[2-[tert-butyl(dimethyl)silyl]oxyethyl-[2-(1H-indol-3-yl)ethyl]amino]methyl]phenyl]sulfonylpyrrol-3-yl]prop-2-enoate

이름 및 동의어

SCHEMBL296351RQWQQFCIPBAZHZ-OBGWFSINSA-N(E)-3-{1-[4-({[2-(tert-Butyl-dimethyl-silanyloxy)-ethyl]-[2(1H-indol-3-yl)-ethyl]-amino}-methyl)-benzenesulfonyl]-1H-pyrrol-3-yl}-acrylic acid tert-butyl ester(E)-3-{1-[4-({[2-(tert-Butyl-dimethyl-silanyloxy)-ethyl]-[2-(1H-indol-3-yl)-ethyl]-amino}-methyl)-benzenesulfonyl]-1H-pyrrol-3-yl}-acrylic acid tert-butyl ester

데이터베이스 식별자

PubChem CID
66646255

물성

구조 계산 물성

극성 표면적
102 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
6
회전 가능 결합 수
16
무거운 원자 수
46

관련 반응

5건

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