7-[2-(Hexadecylamino)ethyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (CAS 52943-52-9) — formula C25H45N5O2, molecular weight 447.7; category organic chemicals.
| CAS Number | 52943-52-9 |
|---|---|
| Molecular Formula | C25H45N5O2 |
| Molecular Weight | 447.7 |
| LogP | 6.8 |
| Category | Organic Chemicals |
7-[2-(Hexadecylamino)ethyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione is a carbon-based organic compound with CAS registry number 52943-52-9 and molecular formula C25H45N5O2 (molecular weight 447.7), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 52943-52-9
Its molecular formula C25H45N5O2 comprises 25 C, 45 H, 5 N, 2 O atoms.
Also known as: 7-[2-(Hexadecylamino)ethyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione · 7-[2-(十六烷基氨基)乙基]-3,7-二氢-1,3-二甲基-1H-嘌呤-2,6-二酮
Category: organic chemicals
The CAS registry number of 7-[2-(Hexadecylamino)ethyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione is 52943-52-9.
Molecular formula C25H45N5O2, molecular weight 447.7.
It is also registered under: 7-[2-(Hexadecylamino)ethyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione, 7-[2-(十六烷基氨基)乙基]-3,7-二氢-1,3-二甲基-1H-嘌呤-2,6-二酮.
Category: Organic Chemicals.
Independent reference data for 7-[2-(Hexadecylamino)ethyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (CAS 52943-52-9), compiled from public chemistry databases.
| CAS 号 | 52943-52-9 |
|---|---|
| PubChem CID | 3040786 |
| 分子式 | C25H45N5O2 |
| IUPAC 名称 | 7-[2-(hexadecylamino)ethyl]-1,3-dimethylpurine-2,6-dione |
| Molecular Weight | 447.7 |
|---|---|
| XLogP3 | 6.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 18 |
| Exact Mass | 447.35732570 |
| Monoisotopic Mass | 447.35732570 |
| Topological Polar Surface Area | 70.5 |
| Heavy Atom Count | 32 |
52943-52-9; Theophylline, 7-(2-(hexadecylamino)ethyl)-; 7-(2-(Hexadecylamino)ethyl)theophylline; BRN 1179768; 1H-Purine-2,6-dione, 7-(2-(hexadecylamino)ethyl)-3,7-dihydro-1,3-dimethyl-; DTXSID20200989; DB-318232; 7-(2-(Hexadecylamino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione; 7-[2-(Hexadecylamino)ethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione; 7-[2-(Hexadecylamino)ethyl ]-3,7-dihydro-1,3-dimethyl-1h-purine-2,6-dione
7-[2-(十六烷基氨基)乙基]-3,7-二氢-1,3-二甲基-1H-嘌呤-2,6-二酮 · CAS 52943-52-9 · C25H45N5O2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.