1-Piperazineethanol, 4-(p-chlorobenzyl)-alpha-(1,3-dimethyl-7-xanthiny lmethyl)-, acetate (ester) (CAS 20630-44-8) — formula C23H29ClN6O4, molecular weight 489.0; category organic chemicals.
| CAS Number | 20630-44-8 |
|---|---|
| Molecular Formula | C23H29ClN6O4 |
| Molecular Weight | 489.0 |
| LogP | 1.4 |
| Category | Organic Chemicals |
1-Piperazineethanol, 4-(p-chlorobenzyl)-alpha-(1,3-dimethyl-7-xanthiny lmethyl)-, acetate (ester) is a carbon-based organic compound with CAS registry number 20630-44-8 and molecular formula C23H29ClN6O4 (molecular weight 489.0), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 20630-44-8
Its molecular formula C23H29ClN6O4 comprises 23 C, 29 H, 1 Cl, 6 N, 4 O atoms.
Also known as: 1-Piperazineethanol, 4-(p-chlorobenzyl)-alpha-(1,3-dimethyl-7-xanthiny lmethyl)-, acetate (ester) · 1-哌嗪乙醇，4-(对氯苄基)-α-(1,3-二甲基-7-黄嘌呤甲基)-乙酸酯（酯）
Category: organic chemicals
The CAS registry number of 1-Piperazineethanol, 4-(p-chlorobenzyl)-alpha-(1,3-dimethyl-7-xanthiny lmethyl)-, acetate (ester) is 20630-44-8.
Molecular formula C23H29ClN6O4, molecular weight 489.0.
It is also registered under: 1-Piperazineethanol, 4-(p-chlorobenzyl)-alpha-(1,3-dimethyl-7-xanthiny lmethyl)-, acetate (ester), 1-哌嗪乙醇，4-(对氯苄基)-α-(1,3-二甲基-7-黄嘌呤甲基)-乙酸酯（酯）.
Category: Organic Chemicals.
Independent reference data for 1-Piperazineethanol, 4-(p-chlorobenzyl)-alpha-(1,3-dimethyl-7-xanthiny lmethyl)-, acetate (ester) (CAS 20630-44-8), compiled from public chemistry databases.
| CAS 号 | 20630-44-8 |
|---|---|
| PubChem CID | 209860 |
| 分子式 | C23H29ClN6O4 |
| IUPAC 名称 | [1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-(1,3-dimethyl-2,6-dioxopurin-7-yl)propan-2-yl] acetate |
| Molecular Weight | 489.0 |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 8 |
| Exact Mass | 488.1938811 |
| Monoisotopic Mass | 488.1938811 |
| Topological Polar Surface Area | 91.2 |
| Heavy Atom Count | 34 |
BRN 0598468; 20630-44-8; Theophylline, 7-(2-acetoxy-3-(4-(p-chlorobenzyl)-1-piperazinyl)propyl)-; 5-26-14-00059 (Beilstein Handbook Reference); 1-Piperazineethanol, 4-(p-chlorobenzyl)-alpha-(1,3-dimethyl-7-xanthinylmethyl)-, acetate (ester); RefChem:233884; DTXSID30942828
1-哌嗪乙醇，4-(对氯苄基)-α-(1,3-二甲基-7-黄嘌呤甲基)-乙酸酯（酯） · CAS 20630-44-8 · C23H29ClN6O4.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.