(3aS,6aR)-1-methanesulfonyl-4-[(2E)-4-(piperidin-1-yl)but-2-enoyl]-3-(propan-2-yl)-octahydropyrrolo[3,2-b]pyrrol-2-one hydrochloride
Structure Info
- Chemspace ID
- CSSB02531768306 (In-Stock Building Blocks)
- CAS
- 198062-54-3
- MFCD
- MFCD28168015
- IUPAC Name
- (3aS,6aR)-1-methanesulfonyl-4-[(2E)-4-(piperidin-1-yl)but-2-enoyl]-3-(propan-2-yl)-octahydropyrrolo[3,2-b]pyrrol-2-one hydrochloride
- Mol formula
- C19H32ClN3O4S
- Mol weight
- 434 Da
- Catalog Number(s)
- T96142
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.56
- Heavy atoms count
- 28
- Rotatable bond count
- 4
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.789
- Polar surface area (Å)
- 78
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 0
![Chemical structure of (3aS,6aR)-1-methanesulfonyl-4-[(2E)-4-(piperidin-1-yl)but-2-enoyl]-3-(propan-2-yl)-octahydropyrrolo[3,2-b]pyrrol-2-one hydrochloride (C19H32ClN3O4S) - CSSB02531768306](/st/structure/200/7e47f484804a80adaf36dff8ee79d88f/Cl.CC%2528C%2529C1%255BC%2540H%255D2%255BC%2540%2540H%255D%2528CCN2C%2528%253DO%2529%255CC%253DC%255CCN2CCCCC2%2529N%2528C1%253DO%2529S%2528C%2529%2528%253DO%2529%253DO.png "C19H32ClN3O4S")
- Zoom the structure
- CSSB02531768306
Items Overall 2 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Advanced ChemBlocks CN | 10 days | China To: | 98 | 2 mg | 705.00 | |
| Advanced ChemBlocks CN | 10 days | China To: | 98 | 5 mg | 1,130.00 | |
Description: GW311616; CAS: 198062-54-3 | ||||||
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Substructure Analogs
![Chemical structure of (3S,3aS,6aR)-1-methanesulfonyl-4-[(2E)-4-(piperidin-1-yl)but-2-enoyl]-3-(propan-2-yl)-octahydropyrrolo[3,2-b]pyrrol-2-one hydrochloride - CSSB00134617759](/st/structure/200/642de9baa5ab439574003185799852c0/Cl.CC%2528C%2529%255BC%2540H%255D1%255BC%2540H%255D2%255BC%2540%2540H%255D%2528CCN2C%2528%253DO%2529%255CC%253DC%255CCN2CCCCC2%2529N%2528C1%253DO%2529S%2528C%2529%2528%253DO%2529%253DO.png)
Similarity Analogs
![Chemical structure of (3S,3aS,6aR)-1-methanesulfonyl-4-[(2E)-4-(piperidin-1-yl)but-2-enoyl]-3-(propan-2-yl)-octahydropyrrolo[3,2-b]pyrrol-2-one - CSSB00103151711](/st/structure/200/9561514df3c5ad820f45c7a1a3a6784e/CC%2528C%2529%255BC%2540H%255D1%255BC%2540H%255D2%255BC%2540%2540H%255D%2528CCN2C%2528%253DO%2529%255CC%253DC%255CCN2CCCCC2%2529N%2528C1%253DO%2529S%2528C%2529%2528%253DO%2529%253DO.png)
![Chemical structure of 1-{2-[1-(thiophene-2-carbonyl)piperidin-2-yl]ethyl}azepane - CSSB00027512079](/st/structure/200/5652bba86ff385fd3a56e48d50704a87/O%253DC%2528N1CCCCC1CCN1CCCCCC1%2529C1%253DCC%253DCS1.png)
