2-[[3-[4-(benzyl)-1-piperazinyl]propyl]thio]-1H-indole monohydrochloride (CAS 94441-96-0) — formula C22H28ClN3S, molecular weight 402.0; category organic chemicals.
| CAS Number | 94441-96-0 |
|---|---|
| Molecular Formula | C22H28ClN3S |
| Molecular Weight | 402.0 |
| Category | Organic Chemicals |
2-[[3-[4-(benzyl)-1-piperazinyl]propyl]thio]-1H-indole monohydrochloride is a carbon-based organic compound with CAS registry number 94441-96-0 and molecular formula C22H28ClN3S (molecular weight 402.0), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 94441-96-0
Its molecular formula C22H28ClN3S comprises 22 C, 28 H, 1 Cl, 3 N, 1 S atoms.
Also known as: 2-[[3-[4-(benzyl)-1-piperazinyl]propyl]thio]-1H-indole monohydrochloride · 2-[[3-[4-(苄基)-1-哌嗪基]丙基]硫基]-1H-吲哚单盐酸盐
Category: organic chemicals
The CAS registry number of 2-[[3-[4-(benzyl)-1-piperazinyl]propyl]thio]-1H-indole monohydrochloride is 94441-96-0.
Molecular formula C22H28ClN3S, molecular weight 402.0.
It is also registered under: 2-[[3-[4-(benzyl)-1-piperazinyl]propyl]thio]-1H-indole monohydrochloride, 2-[[3-[4-(苄基)-1-哌嗪基]丙基]硫基]-1H-吲哚单盐酸盐.
Category: Organic Chemicals.
Independent reference data for 2-[[3-[4-(benzyl)-1-piperazinyl]propyl]thio]-1H-indole monohydrochloride (CAS 94441-96-0), compiled from public chemistry databases.
| CAS 号 | 94441-96-0 |
|---|---|
| PubChem CID | 3024356 |
| 分子式 | C22H28ClN3S |
| IUPAC 名称 | 2-[3-(4-benzylpiperazin-1-yl)propylsulfanyl]-1H-indole;hydrochloride |
| UNII（FDA） | NS00065781 |
| Molecular Weight | 402.0 |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 7 |
| Exact Mass | 401.1692468 |
| Monoisotopic Mass | 401.1692468 |
| Topological Polar Surface Area | 47.6 |
| Heavy Atom Count | 27 |
94441-96-0; EINECS 305-321-2; 2-((3-(4-(Benzyl)-1-piperazinyl)propyl)thio)-1H-indole monohydrochloride; 2-[[3-[4-(benzyl)-1-piperazinyl]propyl]thio]-1h-indole hydrochloride; DTXSID70241488; NLSGHWHLZQAOCD-UHFFFAOYSA-N; NS00065781; 2-{[3-(4-Benzylpiperazin-1-yl)propyl]sulfanyl}-1H-indole--hydrogen chloride (1/1)
2-[[3-[4-(苄基)-1-哌嗪基]丙基]硫基]-1H-吲哚单盐酸盐 · CAS 94441-96-0 · C22H28ClN3S. UNII NS00065781.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.