3-[2-(3,4-dimethoxyphenyl)ethyl]-7-methyl-3,5,8,9-tetrazabicyclo[4.3.0 ]nona-4,6,9-trien-2-one (CAS 86927-76-6) — formula C16H18N4O3, molecular weight 314.34; category organic chemicals.
| CAS Number | 86927-76-6 |
|---|---|
| Molecular Formula | C16H18N4O3 |
| Molecular Weight | 314.34 |
| LogP | 1.8 |
| Category | Organic Chemicals |
3-[2-(3,4-dimethoxyphenyl)ethyl]-7-methyl-3,5,8,9-tetrazabicyclo[4.3.0 ]nona-4,6,9-trien-2-one is a carbon-based organic compound with CAS registry number 86927-76-6 and molecular formula C16H18N4O3 (molecular weight 314.34), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 86927-76-6
Its molecular formula C16H18N4O3 comprises 16 C, 18 H, 4 N, 3 O atoms.
Also known as: 3-[2-(3,4-dimethoxyphenyl)ethyl]-7-methyl-3,5,8,9-tetrazabicyclo[4.3.0 ]nona-4,6,9-trien-2-one · 3-[2-(3,4-二甲氧基苯基)乙基]-7-甲基-3,5,8,9-四氮杂双环[4.3.0]nona-4,6,9-三烯-2-酮
Category: organic chemicals
The CAS registry number of 3-[2-(3,4-dimethoxyphenyl)ethyl]-7-methyl-3,5,8,9-tetrazabicyclo[4.3.0 ]nona-4,6,9-trien-2-one is 86927-76-6.
Molecular formula C16H18N4O3, molecular weight 314.34.
It is also registered under: 3-[2-(3,4-dimethoxyphenyl)ethyl]-7-methyl-3,5,8,9-tetrazabicyclo[4.3.0 ]nona-4,6,9-trien-2-one, 3-[2-(3,4-二甲氧基苯基)乙基]-7-甲基-3,5,8,9-四氮杂双环[4.3.0]nona-4,6,9-三烯-2-酮.
Category: Organic Chemicals.
Independent reference data for 3-[2-(3,4-dimethoxyphenyl)ethyl]-7-methyl-3,5,8,9-tetrazabicyclo[4.3.0 ]nona-4,6,9-trien-2-one (CAS 86927-76-6), compiled from public chemistry databases.
| CAS 号 | 86927-76-6 |
|---|---|
| PubChem CID | 3070852 |
| 分子式 | C16H18N4O3 |
| IUPAC 名称 | 6-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-2H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight | 314.34 |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 314.13789045 |
| Monoisotopic Mass | 314.13789045 |
| Topological Polar Surface Area | 79.8 |
| Heavy Atom Count | 23 |
86927-76-6; 7H-Pyrazolo(4,3-d)pyrimidin-7-one, 1,6-dihydro-6-(2-(3,4-dimethoxyphenyl)ethyl)-3-methyl-; 1,6-Dihydro-6-(2-(3,4-dimethoxyphenyl)ethyl)-3-methyl-7H-pyrazolo(4,3-d)pyrimidin-7-one; DTXSID90235980; RefChem:311468; DTXCID20158471; 6-(3,4-Dimethoxyphenethyl)-3-methyl-2H-pyrazolo[4,3-d]pyrimidin-7(6H)-one; 6-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-2H,6H,7H-pyrazolo[4,3-d]pyrimidin-7-one; 6-[2-(3,4-Dimethoxyphenyl)ethyl]-3-methyl-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
3-[2-(3,4-二甲氧基苯基)乙基]-7-甲基-3,5,8,9-四氮杂双环[4.3.0]nona-4,6,9-三烯-2-酮 · CAS 86927-76-6 · C16H18N4O3.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-[2-(3,4-二甲氧基苯基)乙基]-7-甲基-3,5,8,9-四氮杂双环[4.3.0]nona-4,6,9-三烯-2-酮