8,8'-Tetramethylenebis(1,2,3,7-tetrahydro-1,3-dimethyl-2-thioxo-6H-purin-6-one) (CAS 6466-30-4) — formula C18H22N8O2S2, molecular weight 446.6; category organic chemicals.
| CAS Number | 6466-30-4 |
|---|---|
| Molecular Formula | C18H22N8O2S2 |
| Molecular Weight | 446.6 |
| LogP | 1.5 |
| Category | Organic Chemicals |
8,8'-Tetramethylenebis(1,2,3,7-tetrahydro-1,3-dimethyl-2-thioxo-6H-purin-6-one) is a carbon-based organic compound with CAS registry number 6466-30-4 and molecular formula C18H22N8O2S2 (molecular weight 446.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 6466-30-4
Its molecular formula C18H22N8O2S2 comprises 18 C, 22 H, 8 N, 2 O, 2 S atoms.
Also known as: 8,8'-Tetramethylenebis(1,2,3,7-tetrahydro-1,3-dimethyl-2-thioxo-6H-purin-6-one) · 8,8'-四亚甲基双(1,2,3,7-四氢-1,3-二甲基-2-硫代-6H-嘌呤-6-酮)
Category: organic chemicals
The CAS registry number of 8,8'-Tetramethylenebis(1,2,3,7-tetrahydro-1,3-dimethyl-2-thioxo-6H-purin-6-one) is 6466-30-4.
Molecular formula C18H22N8O2S2, molecular weight 446.6.
It is also registered under: 8,8'-Tetramethylenebis(1,2,3,7-tetrahydro-1,3-dimethyl-2-thioxo-6H-purin-6-one), 8,8'-四亚甲基双(1,2,3,7-四氢-1,3-二甲基-2-硫代-6H-嘌呤-6-酮).
Category: Organic Chemicals.
Independent reference data for 8,8'-Tetramethylenebis(1,2,3,7-tetrahydro-1,3-dimethyl-2-thioxo-6H-purin-6-one) (CAS 6466-30-4), compiled from public chemistry databases.
| CAS 号 | 6466-30-4 |
|---|---|
| PubChem CID | 201649 |
| 分子式 | C18H22N8O2S2 |
| IUPAC 名称 | 8-[4-(1,3-dimethyl-6-oxo-2-sulfanylidene-7H-purin-8-yl)butyl]-1,3-dimethyl-2-sulfanylidene-7H-purin-6-one |
| UNII（FDA） | 73I5J2YXW9 |
| Molecular Weight | 446.6 |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 446.13071432 |
| Monoisotopic Mass | 446.13071432 |
| Topological Polar Surface Area | 169 |
| Heavy Atom Count | 30 |
6466-30-4; Theophylline, 8,8'-tetramethylenebis(2-thio-; NSC 95926; NSC-95926; BRN 1194378; 73I5J2YXW9; 8,8-Tetramethylene-bis-(2-thiotheophylline); UNII-73I5J2YXW9; DTXSID10214934; 8,8'-(1,4-Butanediyl)bis(1,2,3,9-tetrahydro-1,3-dimethyl-2-thioxo-6H-purin-6-one); 6H-PURIN-6-ONE, 8,8'-(1,4-BUTANEDIYL)BIS(1,2,3,9-TETRAHYDRO-1,3-DIMETHYL-2-THIOXO-; RefChem:199205; DTXCID40137425; NSC95926; 8,8'-(Butane-1,4-diyl)bis(1,3-dimethyl-2-thioxo-2,3-dihydro-1H-purin-6(9H)-one); NCIStruc1_001561
8,8'-四亚甲基双(1,2,3,7-四氢-1,3-二甲基-2-硫代-6H-嘌呤-6-酮) · CAS 6466-30-4 · C18H22N8O2S2. UNII 73I5J2YXW9.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.