6-(5-chloro-1,8-naphthyridin-2-yl)-2,3,6,7-tetrahydro-7-oxo-5H-1,4-dithiino[2,3-c]pyrrol-5-yl 4-methylpiperazine-1-carboxylate (CAS 53788-22-0) — formula C20H20ClN5O3S2, molecular weight 478.0; category organic chemicals.
| CAS Number | 53788-22-0 |
|---|---|
| Molecular Formula | C20H20ClN5O3S2 |
| Molecular Weight | 478.0 |
| LogP | 2.4 |
| Category | Organic Chemicals |
6-(5-chloro-1,8-naphthyridin-2-yl)-2,3,6,7-tetrahydro-7-oxo-5H-1,4-dithiino[2,3-c]pyrrol-5-yl 4-methylpiperazine-1-carboxylate is a carbon-based organic compound with CAS registry number 53788-22-0 and molecular formula C20H20ClN5O3S2 (molecular weight 478.0), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 53788-22-0
Its molecular formula C20H20ClN5O3S2 comprises 20 C, 20 H, 1 Cl, 5 N, 3 O, 2 S atoms.
Also known as: 6-(5-chloro-1,8-naphthyridin-2-yl)-2,3,6,7-tetrahydro-7-oxo-5H-1,4-dithiino[2,3-c]pyrrol-5-yl 4-methylpiperazine-1-carboxylate · 6-(5-氯-1,8-萘啶-2-基)-2,3,6,7-四氢-7-氧代-5H-1,4-二硫代[2,3-c]吡咯-5-基4-甲基哌嗪-1-甲酸酯
Category: organic chemicals
The CAS registry number of 6-(5-chloro-1,8-naphthyridin-2-yl)-2,3,6,7-tetrahydro-7-oxo-5H-1,4-dithiino[2,3-c]pyrrol-5-yl 4-methylpiperazine-1-carboxylate is 53788-22-0.
Molecular formula C20H20ClN5O3S2, molecular weight 478.0.
It is also registered under: 6-(5-chloro-1,8-naphthyridin-2-yl)-2,3,6,7-tetrahydro-7-oxo-5H-1,4-dithiino[2,3-c]pyrrol-5-yl 4-methylpiperazine-1-carboxylate, 6-(5-氯-1,8-萘啶-2-基)-2,3,6,7-四氢-7-氧代-5H-1,4-二硫代[2,3-c]吡咯-5-基4-甲基哌嗪-1-甲酸酯.
Category: Organic Chemicals.
Independent reference data for 6-(5-chloro-1,8-naphthyridin-2-yl)-2,3,6,7-tetrahydro-7-oxo-5H-1,4-dithiino[2,3-c]pyrrol-5-yl 4-methylpiperazine-1-carboxylate (CAS 53788-22-0), compiled from public chemistry databases.
| CAS 号 | 53788-22-0 |
|---|---|
| PubChem CID | 103838 |
| 分子式 | C20H20ClN5O3S2 |
| IUPAC 名称 | [6-(5-chloro-1,8-naphthyridin-2-yl)-5-oxo-3,7-dihydro-2H-[1,4]dithiino[2,3-c]pyrrol-7-yl] 4-methylpiperazine-1-carboxylate |
| UNII（FDA） | NS00057728 |
| Molecular Weight | 478.0 |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 3 |
| Exact Mass | 477.0696096 |
| Monoisotopic Mass | 477.0696096 |
| Topological Polar Surface Area | 129 |
| Heavy Atom Count | 31 |
53788-22-0; EINECS 258-778-4; SCHEMBL11836581; DTXSID00968570; DB-229437; NS00057728
6-(5-氯-1,8-萘啶-2-基)-2,3,6,7-四氢-7-氧代-5H-1,4-二硫代[2,3-c]吡咯-5-基4-甲基哌嗪-1-甲酸酯 · CAS 53788-22-0 · C20H20ClN5O3S2. UNII NS00057728.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 6-(5-氯-1,8-萘啶-2-基)-2,3,6,7-四氢-7-氧代-5H-1,4-二硫代[2,3-c]吡咯-5-基4-甲基哌嗪-1-甲酸酯