기본 정보
- CAS
332043-49-9- 표준 SMILES
COC(=O)C1=C(C(=O)OC)SC(=C2C(=S)C(C)(C)N(CC(=O)c3ccccc3)c3cc(C)c(C)cc32)S1- InChIKey
SLTDAQBSEHCRGI-UHFFFAOYSA-N- 분자식
- C28H27NO5S3
- 평균 분자량
- 553.7 g/mol
이름 및 식별자
- 우선 이름
- Dimethyl 2-(2,2,6,7-tetramethyl-1-phenacyl-3-sulfanylidenequinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylate
- IUPAC
- dimethyl 2-(2,2,6,7-tetramethyl-1-phenacyl-3-sulfanylidenequinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylate
- 영어명
- dimethyl 2-(2,2,6,7-tetramethyl-1-(2-oxo-2-phenylethyl)-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4,5-dicarboxylate
- 분자식
- C28H27NO5S3
- 분자량
- 553.71
이름 및 동의어
dimethyl 2-(2,2,6,7-tetramethyl-1-(2-oxo-2-phenylethyl)-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4,5-dicarboxylatedimethyl 2-(2,2,6,7-tetramethyl-1-(2-oxo-2-phenylethyl)-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylatedimethyl 2-[2,2,6,7-tetramethyl-1-(2-oxo-2-phenylethyl)-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylateSTK039944AKOS000619961dimethyl 2-(2,2,6,7-tetramethyl-1-phenacyl-3-sulfanylidenequinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylateST50103355AG-690/12247018SR-01000465546SR-01000465546-14,5-DIMETHYL 2-[2,2,6,7-TETRAMETHYL-1-(2-OXO-2-PHENYLETHYL)-3-SULFANYLIDENE-1,2,3,4-TETRAHYDROQUINOLIN-4-YLIDENE]-2H-1,3-DITHIOLE-4,5-DICARBOXYLATEmethyl 5-(methoxycarbonyl)-2-[2,2,6,7-tetramethyl-1-(2-oxo-2-phenylethyl)-3-th ioxo(4-1,2-dihydroquinolylidene)]-1,3-dithiolene-4-carboxylate
이름 더 보기
1,3-Dithiole-4,5-dicarboxylic acid, 2-[2,3-dihydro-2,2,6,7-tetramethyl-1-(2-oxo-2-phenylethyl)-3-thioxo-4(1H)-quinolinylidene]-, 4,5-dimethyl ester
물성
구조 계산 물성
- XLogP
- 6.3
- 극성 표면적
- 156 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 37
- 형식 전하
- 0
- 복잡도
- 1,010
화학 및 산업
공급사3 곳
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