基本情報
- CAS
173154-01-3- 標準SMILES
CC(C)[C@@H]1C[C@@H]([C@H](C[C@H](C(=O)N2C(=O)OC[C@@H]2Cc2ccccc2)C(C)C)N=[N+]=[N-])OC1=O- InChIKey
AZMFFFCHYNXWLN-SXYSDOLCSA-N- 分子式
- C24H32N4O5
- 平均分子量
- 456.5 g/mol
- 単同位体質量
- 456.23727012
名称と識別子
- 優先名称
- 2-Oxazolidinone, 3-[(2S,4S)-4-azido-2-(1-methylethyl)-1-oxo-4-[(2S,4S)-tetrahydro-4-(1-methylethyl)-5-oxo-2-furanyl]butyl]-4-(phenylmethyl)-, (4S)-
- IUPAC
- (4S)-3-[(2S,4S)-4-azido-4-[(2S,4S)-5-oxo-4-propan-2-yloxolan-2-yl]-2-propan-2-ylbutanoyl]-4-benzyl-1,3-oxazolidin-2-one
- 英語名
- (4S)-3-[(2S,4S)-4-Azido-2-(1-Methylethyl)-1-oxo-4-[(2S,4S)-tetrahydro-4-(1-Methylethyl)-5-oxo-2-furanyl]butyl]-4-(phenylMethyl)-2-Oxazolidinone
- 分子式
- C24H32N4O5
- 分子量
- 456.54
名称と別名
173154-01-3(4S)-3-[(2S,4S)-4-azido-4-[(2S,4S)-5-oxo-4-propan-2-yloxolan-2-yl]-2-propan-2-ylbutanoyl]-4-benzyl-1,3-oxazolidin-2-one2-Oxazolidinone, 3-[(2S,4S)-4-azido-2-(1-methylethyl)-1-oxo-4-[(2S,4S)-tetrahydro-4-(1-methylethyl)-5-oxo-2-furanyl]butyl]-4-(phenylmethyl)-, (4S)-(4S)-3-[(2S,4S)-4-Azido-2-(1-methylethyl)-1-oxo-4-[(2S,4S)-tetrahydro-4-(1-methylethyl)-5-oxo-2-furanyl]butyl]-4-(phenylmethyl)-2-oxazolidinoneAliskiren intermediate EAZMFFFCHYNXWLN-SXYSDOLCSA-NDTXSID30693742AKOS015951414(S)-3-((2S,4S)-4-azido-2-isopropyl-4-((2S,4S)-4-isopropyl-5-oxotetrahydrofuran-2-yl)butanoyl)-4-benzyloxazolidin-2-one(4S)-3-[(2S,4S)-4-Azido-2-(1-Methylethyl)-1-oxo-4-[(2S,4S)-tetrahydro-4-(1-Methylethyl)-5-oxo-2-fura(4S)-3-[(2S,4S)-4-Azido-4-[(2S,4S)-5-oxo-4-(propan-2-yl)oxolan-2-yl]-2-(propan-2-yl)butanoyl]-4-benzyl-1,3-oxazolidin-2-one3(S)-Isopropyl-5(S)-{1(S)-azido-4-methyl-3(S)-[(4(S)-benzyl-oxazolidin-2-on-3-yl)-carbonyl]-pentyl}-tetrahydrofuran-2-one
名称をさらに表示
(4S)-3-[(2S,4S)-4-azido-2-isopropyl-4-[(2S,4S)-4-isopropyl-5...(4S)-3-[(2S,4S)-4-azido-2-isopropyl-4-[(2S,4S)-4-isopropyl-5-oxo-tetrahydrofuran-2-yl]butanoyl]-4-benzyl-oxazolidin-2-one3-[4-azido-2-(1-Methylethyl)-1-oxo-4-[tetrahydro-4-(1-Methylethyl)-5-oxo-2-furanyl]butyl]-4-(phenylMethyl)-, [2S-[2[1(R*),2R*,4R*],4]]-2-oxazolidinone2-Oxazolidinone, 3-[4-azido-2-(1-Methylethyl)-1-oxo-4-[tetrahydro-4-(1-Methylethyl)-5-oxo-2-furanyl]butyl]-4-(phenylMethyl)-, [2S-[2[1(R*),2R*,4R*],4]]-
データベース識別子
- CAS
173154-01-3- PubChem CID
- 53385507
- DTXSID
DTXSID30693742- EC Number
- 605-665-6
物性
構造計算による物性
- XLogP
- 5.7
- 極性表面積
- 87.3 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 7
- 回転可能結合数
- 9
- 重原子数
- 33
- 形式電荷
- 0
- 複雑度
- 773
物理化学的性質
- 融点
- 105 ℃ · 105℃
- 酸解離定数(Pka)
- -2.364 · -2.364±0.40(predicted)
化学と産業
サプライヤー12 社
吉林中科研伸科技有限公司18143011203 · [email protected]
郑州安步防护用具有限公司+86-0371-88006763; +86-15988602810 · [email protected]
湖南华腾制药有限公司400-8592883 · [email protected]
上海孚一生物科技有限公司+86 (21) 61124340
湖北康鑫源顺医药化工有限公司027-51831887 15337167856 · [email protected]
南京克罗托鲁宁医药科技有限公司13382066392
career henan chemical co+86-0371-86658258 · [email protected]
爱诗伦生物科技(上海)有限公司021-50676523 18019098996 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
重庆卡兰医药有限公司[email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
AFINE CHEMICALS LIMITED+86-571-85134551 +86-18958018566 · [email protected]
関連反応
7 件
化合物ノート
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