1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-(2-(4-methylphenyl)-2- oxoethyl)-8-(1-piperidinyl)- (CAS 96885-58-4) — formula C21H25N5O3, molecular weight 395.5; category organic chemicals.
| CAS Number | 96885-58-4 |
|---|---|
| Molecular Formula | C21H25N5O3 |
| Molecular Weight | 395.5 |
| LogP | 2.7 |
| Category | Organic Chemicals |
1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-(2-(4-methylphenyl)-2- oxoethyl)-8-(1-piperidinyl)- is a carbon-based organic compound with CAS registry number 96885-58-4 and molecular formula C21H25N5O3 (molecular weight 395.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 96885-58-4
Its molecular formula C21H25N5O3 comprises 21 C, 25 H, 5 N, 3 O atoms.
Also known as: 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-(2-(4-methylphenyl)-2- oxoethyl)-8-(1-piperidinyl)- · 1H-嘌呤-2,6-二酮，3,7-二氢-1,3-二甲基-7-(2-(4-甲基苯基)-2-氧代乙基)-8-(1-哌啶基)-
Category: organic chemicals
The CAS registry number of 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-(2-(4-methylphenyl)-2- oxoethyl)-8-(1-piperidinyl)- is 96885-58-4.
Molecular formula C21H25N5O3, molecular weight 395.5.
It is also registered under: 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-(2-(4-methylphenyl)-2- oxoethyl)-8-(1-piperidinyl)-, 1H-嘌呤-2,6-二酮，3,7-二氢-1,3-二甲基-7-(2-(4-甲基苯基)-2-氧代乙基)-8-(1-哌啶基)-.
Category: Organic Chemicals.
Independent reference data for 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-(2-(4-methylphenyl)-2- oxoethyl)-8-(1-piperidinyl)- (CAS 96885-58-4), compiled from public chemistry databases.
| CAS 号 | 96885-58-4 |
|---|---|
| PubChem CID | 3024712 |
| 分子式 | C21H25N5O3 |
| IUPAC 名称 | 1,3-dimethyl-7-[2-(4-methylphenyl)-2-oxoethyl]-8-piperidin-1-ylpurine-2,6-dione |
| Molecular Weight | 395.5 |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 395.19573968 |
| Monoisotopic Mass | 395.19573968 |
| Topological Polar Surface Area | 78.8 |
| Heavy Atom Count | 29 |
BRN 5660099; 7-p-Toluoylmethyl-8-N-piperidinotheophylline; 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-(2-(4-methylphenyl)-2-oxoethyl)-8-(1-piperidinyl)-; 3,7-Dihydro-1,3-dimethyl-7-(2-(p-tolyl)-2-oxoethyl)-8-(1-piperidinyl)-1H-purine-2,6-dione; DTXSID20242607; RefChem:239530; DTXCID10165098; 96885-58-4; 1,3-Dimethyl-7-[2-(4-methylphenyl)-2-oxoethyl]-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
1H-嘌呤-2,6-二酮，3,7-二氢-1,3-二甲基-7-(2-(4-甲基苯基)-2-氧代乙基)-8-(1-哌啶基)- · CAS 96885-58-4 · C21H25N5O3.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 1H-嘌呤-2,6-二酮，3,7-二氢-1,3-二甲基-7-(2-(4-甲基苯基)-2-氧代乙基)-8-(1-哌啶基)-