7-[3-[[2-(3,5-dihydroxyphenyl)-2-oxoethyl](phenylmethyl)amino]propyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride (CAS 40254-73-7) — formula C25H28ClN5O5, molecular weight 514.0; category organic chemicals.
| CAS Number | 40254-73-7 |
|---|---|
| Molecular Formula | C25H28ClN5O5 |
| Molecular Weight | 514.0 |
| Category | Organic Chemicals |
7-[3-[[2-(3,5-dihydroxyphenyl)-2-oxoethyl](phenylmethyl)amino]propyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride is a carbon-based organic compound with CAS registry number 40254-73-7 and molecular formula C25H28ClN5O5 (molecular weight 514.0), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 40254-73-7
Its molecular formula C25H28ClN5O5 comprises 25 C, 28 H, 1 Cl, 5 N, 5 O atoms.
Also known as: 7-[3-[[2-(3,5-dihydroxyphenyl)-2-oxoethyl](phenylmethyl)amino]propyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride · 7-[3-[[2-(3,5-二羟基苯基)-2-氧代乙基](苯基甲基)氨基]丙基]-3,7-二氢-1,3-二甲基-1H-嘌呤-2,6-二酮单盐酸盐
Category: organic chemicals
The CAS registry number of 7-[3-[[2-(3,5-dihydroxyphenyl)-2-oxoethyl](phenylmethyl)amino]propyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride is 40254-73-7.
Molecular formula C25H28ClN5O5, molecular weight 514.0.
It is also registered under: 7-[3-[[2-(3,5-dihydroxyphenyl)-2-oxoethyl](phenylmethyl)amino]propyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride, 7-[3-[[2-(3,5-二羟基苯基)-2-氧代乙基](苯基甲基)氨基]丙基]-3,7-二氢-1,3-二甲基-1H-嘌呤-2,6-二酮单盐酸盐.
Category: Organic Chemicals.
Independent reference data for 7-[3-[[2-(3,5-dihydroxyphenyl)-2-oxoethyl](phenylmethyl)amino]propyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride (CAS 40254-73-7), compiled from public chemistry databases.
| CAS 号 | 40254-73-7 |
|---|---|
| PubChem CID | 3016170 |
| 分子式 | C25H28ClN5O5 |
| IUPAC 名称 | 7-[3-[benzyl-[2-(3,5-dihydroxyphenyl)-2-oxoethyl]amino]propyl]-1,3-dimethylpurine-2,6-dione;hydrochloride |
| UNII（FDA） | NS00057041 |
| Molecular Weight | 514.0 |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 9 |
| Exact Mass | 513.1778967 |
| Monoisotopic Mass | 513.1778967 |
| Topological Polar Surface Area | 119 |
| Heavy Atom Count | 36 |
EINECS 254-859-3; 40254-73-7; DTXSID90193233; RefChem:545062; DTXCID00115724; 254-859-3; SCHEMBL11375990; NS00057041; 7-{3-[2-(3,5-Dihydroxyphenyl)-2-oxo-ethyl-benzyl-amino]-propyl}-theophylline-hydrochloride
7-[3-[[2-(3,5-二羟基苯基)-2-氧代乙基](苯基甲基)氨基]丙基]-3,7-二氢-1,3-二甲基-1H-嘌呤-2,6-二酮单盐酸盐 · CAS 40254-73-7 · C25H28ClN5O5. UNII NS00057041.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 7-[3-[[2-(3,5-二羟基苯基)-2-氧代乙基](苯基甲基)氨基]丙基]-3,7-二氢-1,3-二甲基-1H-嘌呤-2,6-二酮单盐酸盐