Ethanol, 2-[[(3aR,4S,6R,6aS)-6-[[5-amino-6-chloro-2-(propylthio)-4-pyrimidinyl]amino]tetrahydro-2,2-dimethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]- (CAS 376608-74-1) — formula C17H27ClN4O4S, molecular weight 418.9; category organic chemicals.
| CAS Number | 376608-74-1 |
|---|---|
| Molecular Formula | C17H27ClN4O4S |
| Molecular Weight | 418.9 |
| LogP | 2.3 |
| Category | Organic Chemicals |
Ethanol, 2-[[(3aR,4S,6R,6aS)-6-[[5-amino-6-chloro-2-(propylthio)-4-pyrimidinyl]amino]tetrahydro-2,2-dimethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]- is a carbon-based organic compound with CAS registry number 376608-74-1 and molecular formula C17H27ClN4O4S (molecular weight 418.9), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 376608-74-1
Its molecular formula C17H27ClN4O4S comprises 17 C, 27 H, 1 Cl, 4 N, 4 O, 1 S atoms.
Also known as: Ethanol, 2-[[(3aR,4S,6R,6aS)-6-[[5-amino-6-chloro-2-(propylthio)-4-pyrimidinyl]amino]tetrahydro-2,2-dimethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]- · 2-[[(3aR,4S,6R,6aS)-6-[[5-氨基-6-氯-2-(丙硫基)-4-嘧啶基]氨基]四氢-2,2-二甲基-4H-环戊烯并-1,3-二恶茂-4-基]氧基]乙醇
Category: organic chemicals
The CAS registry number of Ethanol, 2-[[(3aR,4S,6R,6aS)-6-[[5-amino-6-chloro-2-(propylthio)-4-pyrimidinyl]amino]tetrahydro-2,2-dimethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]- is 376608-74-1.
Molecular formula C17H27ClN4O4S, molecular weight 418.9.
It is also registered under: Ethanol, 2-[[(3aR,4S,6R,6aS)-6-[[5-amino-6-chloro-2-(propylthio)-4-pyrimidinyl]amino]tetrahydro-2,2-dimethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]-, 2-[[(3aR,4S,6R,6aS)-6-[[5-氨基-6-氯-2-(丙硫基)-4-嘧啶基]氨基]四氢-2,2-二甲基-4H-环戊烯并-1,3-二恶茂-4-基]氧基]乙醇.
Category: Organic Chemicals.
Independent reference data for Ethanol, 2-[[(3aR,4S,6R,6aS)-6-[[5-amino-6-chloro-2-(propylthio)-4-pyrimidinyl]amino]tetrahydro-2,2-dimethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]- (CAS 376608-74-1), compiled from public chemistry databases.
| CAS 号 | 376608-74-1 |
|---|---|
| PubChem CID | 10202186 |
| 分子式 | C17H27ClN4O4S |
| IUPAC 名称 | 2-[[(3aR,4S,6R,6aS)-6-[(5-amino-6-chloro-2-propylsulfanylpyrimidin-4-yl)amino]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl]oxy]ethanol |
| UNII（FDA） | 6QTG8T8EH9 |
| Molecular Weight | 418.9 |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 8 |
| Exact Mass | 418.1441542 |
| Monoisotopic Mass | 418.1441542 |
| Topological Polar Surface Area | 137 |
| Heavy Atom Count | 27 |
RefChem:446825; 468-100-0; 376608-74-1; Ticagrelor intermediate 12; MFCD21362979; 2-[[(3aR,4S,6R,6aS)-6-[[5-Amino-6-chloro-2-(propylthio)-4-pyrimidinyl]amino]tetrahydro-2,2-dimethyl-; Ticagrelor Impurity 47; C17H27ClN4O4S; Ticagrelor-16; Ticagrelor Impurity?1; 6QTG8T8EH9; Ticagrelor Impurity 1(Rsrs); SCHEMBL2131051; DTXSID901101032; CS-M2084; AKOS025396335
2-[[(3aR,4S,6R,6aS)-6-[[5-氨基-6-氯-2-(丙硫基)-4-嘧啶基]氨基]四氢-2,2-二甲基-4H-环戊烯并-1,3-二恶茂-4-基]氧基]乙醇 · CAS 376608-74-1 · C17H27ClN4O4S. UNII 6QTG8T8EH9.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 2-[[(3aR,4S,6R,6aS)-6-[[5-氨基-6-氯-2-(丙硫基)-4-嘧啶基]氨基]四氢-2,2-二甲基-4H-环戊烯并-1,3-二恶茂-4-基]氧基]乙醇