7H-Purine-7-acetamide, 1,2,3,6-tetrahydro-N-(1-(hydroxymethyl)propyl)- 1,3-dimethyl-2,6-dioxo- (CAS 82951-56-2) — formula C13H19N5O4, molecular weight 309.32; category organic chemicals.
| CAS Number | 82951-56-2 |
|---|---|
| Molecular Formula | C13H19N5O4 |
| Molecular Weight | 309.32 |
| LogP | -0.7 |
| Category | Organic Chemicals |
7H-Purine-7-acetamide, 1,2,3,6-tetrahydro-N-(1-(hydroxymethyl)propyl)- 1,3-dimethyl-2,6-dioxo- is a carbon-based organic compound with CAS registry number 82951-56-2 and molecular formula C13H19N5O4 (molecular weight 309.32), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 82951-56-2
Its molecular formula C13H19N5O4 comprises 13 C, 19 H, 5 N, 4 O atoms.
Also known as: 7H-Purine-7-acetamide, 1,2,3,6-tetrahydro-N-(1-(hydroxymethyl)propyl)- 1,3-dimethyl-2,6-dioxo- · 7H-嘌呤-7-乙酰胺，1,2,3,6-四氢-N-(1-(羟甲基)丙基)-1,3-二甲基-2,6-二氧代-
Category: organic chemicals
The CAS registry number of 7H-Purine-7-acetamide, 1,2,3,6-tetrahydro-N-(1-(hydroxymethyl)propyl)- 1,3-dimethyl-2,6-dioxo- is 82951-56-2.
Molecular formula C13H19N5O4, molecular weight 309.32.
It is also registered under: 7H-Purine-7-acetamide, 1,2,3,6-tetrahydro-N-(1-(hydroxymethyl)propyl)- 1,3-dimethyl-2,6-dioxo-, 7H-嘌呤-7-乙酰胺，1,2,3,6-四氢-N-(1-(羟甲基)丙基)-1,3-二甲基-2,6-二氧代-.
Category: Organic Chemicals.
Independent reference data for 7H-Purine-7-acetamide, 1,2,3,6-tetrahydro-N-(1-(hydroxymethyl)propyl)- 1,3-dimethyl-2,6-dioxo- (CAS 82951-56-2), compiled from public chemistry databases.
| CAS 号 | 82951-56-2 |
|---|---|
| PubChem CID | 134127 |
| 分子式 | C13H19N5O4 |
| IUPAC 名称 | 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(1-hydroxybutan-2-yl)acetamide |
| Molecular Weight | 309.32 |
|---|---|
| XLogP3 | -0.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 309.14370410 |
| Monoisotopic Mass | 309.14370410 |
| Topological Polar Surface Area | 108 |
| Heavy Atom Count | 22 |
Theophylline-7-acetylaminobutanol; 82951-56-2; 2-N-(Theophyllinyl-7-acetyl)aminobutanol; 7H-Purine-7-acetamide, 1,2,3,6-tetrahydro-N-(1-(hydroxymethyl)propyl)-1,3-dimethyl-2,6-dioxo-; RefChem:189202; DTXSID601003023; (S)-2-(1,3-Dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N-(1-hydroxybutan-2-yl)acetamide; 2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)-N-[(2S)-1-hydroxybutan-2-yl]acetamide; (1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(1-hydroxybutan-2-yl)ethanimidic acid; 2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(1-hydroxybutan-2-yl)ethanimidic acid
7H-嘌呤-7-乙酰胺，1,2,3,6-四氢-N-(1-(羟甲基)丙基)-1,3-二甲基-2,6-二氧代- · CAS 82951-56-2 · C13H19N5O4.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.