Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HCID 158334635생성일: 2026년 11월 3일
2-aminochloranuidyl-1-[(2R)-4,4-difluoro-2-isocyanopyrrolidin-1-yl]ethanone;1-[(2R)-4,4-difluoro-2-isocyanopyrrolidin-1-yl]-4-(6-oxo-4-phenyl-1H-pyridin-3-yl)butane-1,4-dione;methyl 4-chloro-6-oxo-1H-pyridine-3-carboxylate;methyl 6-oxo-4-phenyl-1H-pyridine-3-carboxylate;6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid;phenylboronic acid
https://huagongshe.com/ko/chemical/158334635
식별자 및 물리적 특성
| 분자식 | C65H59BCl2F4N9O15- |
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| 평균 분자량 | 1,363.9 g/mol |
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| SMILES | B(C1=CC=CC=C1)(O)O.COC(=O)C1=CNC(=O)C=C1C2=CC=CC=C2.COC(=O)C1=CNC(=O)C=C1Cl.[C-]#[N+][C@@H]1CC(CN1C(=O)CCC(=O)C2=CNC(=O)C=C2C3=CC=CC=C3)(F)F.[C-]#[N+][C@@H]1CC(CN1C(=O)C[Cl-]N)(F)F.C1=CC=C(C=C1)C2=CC(=O)NC=C2C(=O)O |
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| InChIKey | ODTVLMFQSODNPT-REBZYMNTSA-N |
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| PubChem CID | 158334635 |
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화학 및 물리적 성질
| 극성 표면적 | 339 |
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| 수소 결합 공여자 수 | 8 |
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| 수소 결합 수용자 수 | 23 |
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| 회전 가능 결합 수 | 14 |
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| 무거운 원자 수 | 96 |
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| 형식 전하 | -1 |
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| 복잡도 | 2,210 |
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![2-aminochloranuidyl-1-[(2R)-4,4-difluoro-2-isocyanopyrrolidin-1-yl]ethanone;1-[(2R)-4,4-difluoro-2-isocyanopyrrolidin-1-yl]-4-(6-oxo-4-phenyl-1H-pyridin-3-yl)butane-1,4-dione;methyl 4-chloro-6-oxo-1H-pyridine-3-carboxylate;methyl 6-oxo-4-phenyl-1H-pyridine-3-carboxylate;6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid;phenylboronic acid 분자 구조식](/img/chemical/158334635.png)