(R)-5-(2-((Tert-butyldimethylsilyl)oxy)ethyl)-4-chloro-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-D]pyrimidine

HCID 86695093

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 1388894-05-0
표준 SMILES: CC(C)(C)[Si](C)(C)OCC[C@H]1CCc2sc3ncnc(Cl)c3c21
InChIKey: JTAASKVSKUEBKH-LLVKDONJSA-N
분자식: C17H25ClN2OSSi
평균 분자량: 369 g/mol
단동위원소 질량: 368.1145388

이름 및 식별자

우선 이름: (R)-5-(2-((Tert-butyldimethylsilyl)oxy)ethyl)-4-chloro-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-D]pyrimidine
IUPAC: tert-butyl-[2-[(3R)-12-chloro-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-3-yl]ethoxy]-dimethylsilane
영어명: (R)-5-(2-((Tert-Butyldimethylsilyl)Oxy)Ethyl)-4-Chloro-6,7-Dihydro-5H-Cyclopenta[4,5]Thieno[2,3-D]Pyrimidine
분자식: C17H25ClN2OSSi
분자량: 369

이름 및 동의어

1388894-05-0(R)-5-(2-((TERT-BUTYLDIMETHYLSILYL)OXY)ETHYL)-4-CHLORO-6,7-DIHYDRO-5H-CYCLOPENTA[4,5]THIENO[2,3-D]PYRIMIDINE(3R)-3-{2-[(tert-butyldimethylsilyl)oxy]ethyl}-12-chloro-7-thia-9,11-diazatricyclo[6.4.0.0(2),?]dodeca-1(12),2(6),8,10-tetraenetert-butyl-[2-[(3R)-12-chloro-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-3-yl]ethoxy]-dimethylsilaneC17H25ClN2OSSiSCHEMBL15112231JTAASKVSKUEBKH-LLVKDONJSA-NDTXSID101105559AKOS030628322AS-74925W12937(3R)-3-[2-[(tert-butyldimethylsilyl)oxy]ethyl]-12-chloro-7-thia-9,11-diazatricyclo[6.4.0.0[2,6]]dodeca-1(12),2(6),8,10-tetraene

이름 더 보기

(R)-5-(2-((Tert-Butyldimethylsilyl)Oxy)Ethyl)-4-Chloro-6,7-Dihydro-5H-Cyclopenta[4,5]Thieno[2,3-D]Pyrimidine(WXC05018)5H-Cyclopenta[4,5]thieno[2,3-d]pyrimidine, 4-chloro-5-[2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]ethyl]-6,7-dihydro-, (5R)-(3R)-3-[2-[(tert-butyldimethylsilyl)oxy]ethyl]-12-chloro-7-thia-9,11-diazatricyclo[6.4.0.0(2,6)]dodeca-1(8),2(6),9,11-tetraene

(3R)-3-[2-[(tert-butyldimethylsilyl)oxy]ethyl]-12-chloro-7-thia-9,11-diazatricyclo[6.4.0.0[2,6]]dodeca-1(8),2(6),9,11-tetraene(3R)-3-[2-[(tert-butyldimethylsilyl)oxy]ethyl]-12-chloro-7-thia-9,11-diazatricyclo[6.4.0.0[2,6]]dodeca-1-(8),2(6),9,11-tetraene(3R)-3-{2-[(tert-butyldimethylsilyl)oxy]ethyl}-12-chloro-7-thia-9,11-diazatricyclo[6.4.0.0?,?]dodeca-1(12),2(6),8,10-tetraene(5R)-4-Chloro-5-[2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]ethyl]-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidinetert-butyl-[2-[(3R)-12-chloro-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-3-yl]ethoxy]-dimethyl-silane

데이터베이스 식별자

CAS: 1388894-05-0
PubChem CID: 86695093
DTXSID: DTXSID101105559

물성

구조 계산 물성

극성 표면적: 63.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 5
무거운 원자 수: 23
형식 전하: 0
복잡도: 431

물리화학적 성질

끓는 점: 427.9 · 427.9±40.0 °C(Predicted)
밀도: 1.155 · 1.155±0.06 g/cm3(Predicted)
산도 계수 (pKa): 0.76 · 0.76±0.40(Predicted)

안전 및 규제

안전 데이터

신호 어: Warning
유해·위험 문구: 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H302

화학 및 산업

상·하류 제품 정보

상류 원료

2-(4-Chloro-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-5-yl)ethanol diethyl 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate ethyl 4-hydroxy-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-5-carboxylate ethyl 2-(4-chloro-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-5-yl)acetate Ethyl 2-oxocyclopentylacetate 터트-뷰틸클로로다이메틸실란

공급사2 곳

药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]

范德(北京)生物科技有限责任公司15911056312 · [email protected]

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