9-butyl-6-[(3-fluorophenyl)methylsulfanyl]purin-2-amine (CAS 1581-22-2) — formula C16H18FN5S, molecular weight 331.4; category organic chemicals.
| CAS Number | 1581-22-2 |
|---|---|
| Molecular Formula | C16H18FN5S |
| Molecular Weight | 331.4 |
| LogP | 3.3 |
| Category | Organic Chemicals |
9-butyl-6-[(3-fluorophenyl)methylsulfanyl]purin-2-amine is a carbon-based organic compound with CAS registry number 1581-22-2 and molecular formula C16H18FN5S (molecular weight 331.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 1581-22-2
Its molecular formula C16H18FN5S comprises 16 C, 18 H, 1 F, 5 N, 1 S atoms.
Also known as: 9-butyl-6-[(3-fluorophenyl)methylsulfanyl]purin-2-amine · 9-丁基-6-[(3-氟苯基)甲硫基]嘌呤-2-胺
Category: organic chemicals
The CAS registry number of 9-butyl-6-[(3-fluorophenyl)methylsulfanyl]purin-2-amine is 1581-22-2.
Molecular formula C16H18FN5S, molecular weight 331.4.
It is also registered under: 9-butyl-6-[(3-fluorophenyl)methylsulfanyl]purin-2-amine, 9-丁基-6-[(3-氟苯基)甲硫基]嘌呤-2-胺.
Category: Organic Chemicals.
Independent reference data for 9-butyl-6-[(3-fluorophenyl)methylsulfanyl]purin-2-amine (CAS 1581-22-2), compiled from public chemistry databases.
| CAS 号 | 1581-22-2 |
|---|---|
| PubChem CID | 241899 |
| 分子式 | C16H18FN5S |
| IUPAC 名称 | 9-butyl-6-[(3-fluorophenyl)methylsulfanyl]purin-2-amine |
| UNII（FDA） | HMS3089I15 |
| Molecular Weight | 331.4 |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 331.12669493 |
| Monoisotopic Mass | 331.12669493 |
| Topological Polar Surface Area | 94.9 |
| Heavy Atom Count | 23 |
1581-22-2; 9-butyl-6-[(3-fluorophenyl)methylsulfanyl]purin-2-amine; MLS002667310; 9-Butyl-6-((3-fluorobenzyl)thio)-9H-purin-2-amine; NSC49819; CHEMBL1736181; DTXSID50287243; HMS3089I15; NSC-49819; SMR001557078; 9-Butyl-6-{[(3-fluorophenyl)methyl]sulfanyl}-9H-purin-2-amine
9-丁基-6-[(3-氟苯基)甲硫基]嘌呤-2-胺 · CAS 1581-22-2 · C16H18FN5S. UNII HMS3089I15.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.