di-tert-butyl 2,2'-(((((2R,5R)-1-(3,5-difluoro-4-(4-(4-fluorophenyl)piperidin-1-yl)phenyl)pyrrolidine-2,5-diyl)bis(2-amino-5-fluoro-4,1-phenylene))bis(azanediyl))bis(carbonyl))(2S,2'S)-bis(pyrrolidine-1-carboxylate) (CAS 2151870-61-8) — formula C53H63F5N8O6, molecular weight 1003.1; category organic chemicals.
| CAS Number | 2151870-61-8 |
|---|---|
| Molecular Formula | C53H63F5N8O6 |
| Molecular Weight | 1003.1 |
| LogP | 8.3 |
| Category | Organic Chemicals |
di-tert-butyl 2,2'-(((((2R,5R)-1-(3,5-difluoro-4-(4-(4-fluorophenyl)piperidin-1-yl)phenyl)pyrrolidine-2,5-diyl)bis(2-amino-5-fluoro-4,1-phenylene))bis(azanediyl))bis(carbonyl))(2S,2'S)-bis(pyrrolidine-1-carboxylate) is a carbon-based organic compound with CAS registry number 2151870-61-8 and molecular formula C53H63F5N8O6 (molecular weight 1003.1), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 2151870-61-8
Its molecular formula C53H63F5N8O6 comprises 53 C, 63 H, 5 F, 8 N, 6 O atoms.
Also known as: di-tert-butyl 2,2'-(((((2R,5R)-1-(3,5-difluoro-4-(4-(4-fluorophenyl)piperidin-1-yl)phenyl)pyrrolidine-2,5-diyl)bis(2-amino-5-fluoro-4,1-phenylene))bis(azanediyl))bis(carbonyl))(2S,2'S)-bis(pyrrolidine-1-carboxylate) · 二叔丁基2,2'-(((((2R,5R)-1-(3,5-二氟-4-(4-(4-氟苯基)哌啶-1-基)苯基)吡咯烷-2,5-二基)双) (2-氨基-5-氟-4,1-亚苯基))双(氮杂二基))双(羰基))(2S,2'S)-双(吡咯烷-1-羧酸酯)
Category: organic chemicals
The CAS registry number of di-tert-butyl 2,2'-(((((2R,5R)-1-(3,5-difluoro-4-(4-(4-fluorophenyl)piperidin-1-yl)phenyl)pyrrolidine-2,5-diyl)bis(2-amino-5-fluoro-4,1-phenylene))bis(azanediyl))bis(carbonyl))(2S,2'S)-bis(pyrrolidine-1-carboxylate) is 2151870-61-8.
Molecular formula C53H63F5N8O6, molecular weight 1003.1.
It is also registered under: di-tert-butyl 2,2'-(((((2R,5R)-1-(3,5-difluoro-4-(4-(4-fluorophenyl)piperidin-1-yl)phenyl)pyrrolidine-2,5-diyl)bis(2-amino-5-fluoro-4,1-phenylene))bis(azanediyl))bis(carbonyl))(2S,2'S)-bis(pyrrolidine-1-carboxylate), 二叔丁基2,2'-(((((2R,5R)-1-(3,5-二氟-4-(4-(4-氟苯基)哌啶-1-基)苯基)吡咯烷-2,5-二基)双) (2-氨基-5-氟-4,1-亚苯基))双(氮杂二基))双(羰基))(2S,2'S)-双(吡咯烷-1-羧酸酯).
Category: Organic Chemicals.
Independent reference data for di-tert-butyl 2,2'-(((((2R,5R)-1-(3,5-difluoro-4-(4-(4-fluorophenyl)piperidin-1-yl)phenyl)pyrrolidine-2,5-diyl)bis(2-amino-5-fluoro-4,1-phenylene))bis(azanediyl))bis(carbonyl))(2S,2'S)-bis(pyrrolidine-1-carboxylate) (CAS 2151870-61-8), compiled from public chemistry databases.
| CAS 号 | 2151870-61-8 |
|---|---|
| PubChem CID | 165365930 |
| 分子式 | C53H63F5N8O6 |
| IUPAC 名称 | tert-butyl (2S)-2-[[2-amino-4-[(2R,5R)-5-[5-amino-2-fluoro-4-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carbonyl]amino]phenyl]-1-[3,5-difluoro-4-[4-(4-fluorophenyl)piperidin-1-yl]phenyl]pyrrolidin-2-yl]-5-fluorophenyl]carbamoyl]pyrrolidine-1-carboxylate |
| Molecular Weight | 1003.1 |
|---|---|
| XLogP3 | 8.3 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 15 |
| Rotatable Bond Count | 13 |
| Exact Mass | 1002.47907257 |
| Monoisotopic Mass | 1002.47907257 |
| Topological Polar Surface Area | 176 |
| Heavy Atom Count | 72 |
二叔丁基2,2'-(((((2R,5R)-1-(3,5-二氟-4-(4-(4-氟苯基)哌啶-1-基)苯基)吡咯烷-2,5-二基)双) (2-氨基-5-氟-4,1-亚苯基))双(氮杂二基))双(羰基))(2S,2'S)-双(吡咯烷-1-羧酸酯) · CAS 2151870-61-8 · C53H63F5N8O6.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.