Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
methyl 2-((3-(4-chlorophenyl)-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate
methyl 2-((3-(4-chlorophenyl)-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate · METHYL {[3-(4-CHLOROPHENYL)-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL]SULFANYL}ACETATE · Acetic acid, 2-[[3-(4-chlorophenyl)-3,4,5,6,7,8-hexahydro-4-oxo[1]benzothieno[2,3-d]pyrimidin-2-yl]thio]-, methyl ester · Methyl 2-{[4-(4-chlorophenyl)-3-oxo-8-thia-4,6-diazatricyclo[7.4.0.0,2,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl}acetate
![methyl 2-((3-(4-chlorophenyl)-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate 분자 구조식](/img/chemical/986113.png)
식별자 및 물리적 특성
| CAS No. | 613227-82-0 |
|---|---|
| 분자식 | C19H17ClN2O3S2 |
| 평균 분자량 | 420.93 g/mol |
| SMILES | COC(=O)CSc1nc2sc3c(c2c(=O)n1-c1ccc(Cl)cc1)CCCC3 |
| InChIKey | JTMRNABFKGAYES-UHFFFAOYSA-N |
| PubChem CID | 986113 |
| EC No. | 103-882-6 |
화학 및 물리적 성질
| 끓는 점 | 618.6±65.0 °C(Predicted) |
|---|---|
| 밀도 | 1.51±0.1 g/cm3(Predicted) |
| pKa(산도 계수) | -1.65±0.20(Predicted) |