8-[4-(1H-Benzimidazol-2-yl)butyl]-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione (CAS 74039-64-8) — formula C18H20N6O2, molecular weight 352.4; category organic chemicals.
| CAS Number | 74039-64-8 |
|---|---|
| Molecular Formula | C18H20N6O2 |
| Molecular Weight | 352.4 |
| LogP | 2.2 |
| Category | Organic Chemicals |
8-[4-(1H-Benzimidazol-2-yl)butyl]-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is a carbon-based organic compound with CAS registry number 74039-64-8 and molecular formula C18H20N6O2 (molecular weight 352.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 74039-64-8
Its molecular formula C18H20N6O2 comprises 18 C, 20 H, 6 N, 2 O atoms.
Also known as: 8-[4-(1H-Benzimidazol-2-yl)butyl]-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione · 8-[4-(1H-苯并咪唑-2-基)丁基]-1,3-二甲基-1H-嘌呤-2,6(3H,7H)-二酮
Category: organic chemicals
The CAS registry number of 8-[4-(1H-Benzimidazol-2-yl)butyl]-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is 74039-64-8.
Molecular formula C18H20N6O2, molecular weight 352.4.
It is also registered under: 8-[4-(1H-Benzimidazol-2-yl)butyl]-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 8-[4-(1H-苯并咪唑-2-基)丁基]-1,3-二甲基-1H-嘌呤-2,6(3H,7H)-二酮.
Category: Organic Chemicals.
Independent reference data for 8-[4-(1H-Benzimidazol-2-yl)butyl]-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione (CAS 74039-64-8), compiled from public chemistry databases.
| CAS 号 | 74039-64-8 |
|---|---|
| PubChem CID | 73250 |
| 分子式 | C18H20N6O2 |
| IUPAC 名称 | 8-[4-(1H-benzimidazol-2-yl)butyl]-1,3-dimethyl-7H-purine-2,6-dione |
| UNII（FDA） | HMS3089M18 |
| Molecular Weight | 352.4 |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 352.16477390 |
| Monoisotopic Mass | 352.16477390 |
| Topological Polar Surface Area | 98 |
| Heavy Atom Count | 26 |
74039-64-8; Theophylline, 8-(4-(2-benzimidazolyl)butyl)-; NSC 81509; 8-(4-(2-Benzimidazolyl)butyl)theophylline; Benzimidazole, 2-(4-(theophyllin-8-yl)butyl)-; DTXSID30224934; 8-[4-(2-Benzimidazolyl)butyl]theophylline; 1H-Purine-2,6-dione, 8-(4-(1H-benzimidazol-2-yl)butyl)-3,7-dihydro-1,3-dimethyl-; Theophylline, 8-[4-(2-benzimidazolyl)butyl]-; RefChem:384456; DTXCID60147425; 1H-Purine-2,6-dione, 8-(4-(1H-benzimidazol-2-yl)butyl)-3,7-dihydro-1,3-dimethyl-(9CI); NSC81509; MLS002694434; NSC-81509; 8-[4-(1H-1,3-benzodiazol-2-yl)butyl]-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
8-[4-(1H-苯并咪唑-2-基)丁基]-1,3-二甲基-1H-嘌呤-2,6(3H,7H)-二酮 · CAS 74039-64-8 · C18H20N6O2. UNII HMS3089M18.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.