3-(5-{4-[2-(methylsulfanyl)acetyl]piperazin-1-yl}-1-oxo-2,3-dihydro-1H-isoindol-2-yl)piperidine-2,6-dione
Structure Info
- Chemspace ID
- CSSB21531607918 (In-Stock Building Blocks)
- IUPAC Name
- 3-(5-{4-[2-(methylsulfanyl)acetyl]piperazin-1-yl}-1-oxo-2,3-dihydro-1H-isoindol-2-yl)piperidine-2,6-dione
- Mol formula
- C20H24N4O4S
- Mol weight
- 417 Da
- Catalog Number(s)
- ACJNJE979
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.08
- Heavy atoms count
- 29
- Rotatable bond count
- 4
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 90
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
![Chemical structure of 3-(5-{4-[2-(methylsulfanyl)acetyl]piperazin-1-yl}-1-oxo-2,3-dihydro-1H-isoindol-2-yl)piperidine-2,6-dione (C20H24N4O4S) - CSSB21531607918](/st/structure/200/03fdf9272ecc61309dd037ee6f400b98/CSCC%2528%253DO%2529N1CCN%2528CC1%2529C1%253DCC%253DC2C%2528CN%2528C3CCC%2528%253DO%2529NC3%253DO%2529C2%253DO%2529%253DC1.png "C20H24N4O4S")
- Zoom the structure
- CSSB21531607918
Items Overall 3 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| AiFChem CN | 10 days | China To: | 95 | 100 mg | 515.00 | |
| AiFChem CN | 10 days | China To: | 95 | 250 mg | 1,029.00 | |
| AiFChem CN | 10 days | China To: | 95 | 1 g | 3,080.00 | |
Description: 3-(5-(4-(2-(methylthio)acetyl)piperazin-1-yl)-1-oxoisoindolin-2-yl)piperidine-2,6-dione | ||||||
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Substructure Analogs
![Chemical structure of 3-(1-oxo-5-{4-[2-(phenylsulfanyl)acetyl]piperazin-1-yl}-2,3-dihydro-1H-isoindol-2-yl)piperidine-2,6-dione - CSSB21531614911](/st/structure/200/38e2ce0a984865ae423a106d54f3b6f6/O%253DC%2528CSC1%253DCC%253DCC%253DC1%2529N1CCN%2528CC1%2529C1%253DCC%253DC2C%2528%253DO%2529N%2528CC2%253DC1%2529C1CCC%2528%253DO%2529NC1%253DO.png)
Similarity Analogs
![Chemical structure of 3-{1-oxo-5-[4-(4-oxopentanoyl)piperazin-1-yl]-2,3-dihydro-1H-isoindol-2-yl}piperidine-2,6-dione - CSSB21531606938](/st/structure/200/b8e833bb0cc8395e95363761f7fab47d/CC%2528%253DO%2529CCC%2528%253DO%2529N1CCN%2528CC1%2529C1%253DCC%253DC2C%2528%253DO%2529N%2528CC2%253DC1%2529C1CCC%2528%253DO%2529NC1%253DO.png)
![Chemical structure of 3-{1-oxo-5-[4-(2-phenoxyacetyl)piperazin-1-yl]-2,3-dihydro-1H-isoindol-2-yl}piperidine-2,6-dione - CSSB21531607541](/st/structure/200/3afc45b5074a42e786615e9d202b9008/O%253DC%2528COC1%253DCC%253DCC%253DC1%2529N1CCN%2528CC1%2529C1%253DCC%253DC2C%2528%253DO%2529N%2528CC2%253DC1%2529C1CCC%2528%253DO%2529NC1%253DO.png)
![Chemical structure of 3-{1-oxo-5-[4-(4-phenylbutanoyl)piperazin-1-yl]-2,3-dihydro-1H-isoindol-2-yl}piperidine-2,6-dione - CSSB21531598469](/st/structure/200/f52a9ef9c6875b38ae835689c8a90dce/O%253DC%2528CCCC1%253DCC%253DCC%253DC1%2529N1CCN%2528CC1%2529C1%253DCC%253DC2C%2528%253DO%2529N%2528CC2%253DC1%2529C1CCC%2528%253DO%2529NC1%253DO.png)
![Chemical structure of 3-[1-oxo-5-(piperazin-1-yl)-2,3-dihydro-1H-isoindol-2-yl]piperidine-2,6-dione - CSSB03496575577](/st/structure/200/fb1f3a0cd1efcdaf4a0b1c33a9a17dce/O%253DC1N%2528CC2%253DCC%2528%253DCC%253DC12%2529N1CCNCC1%2529C1CCC%2528%253DO%2529NC1%253DO.png)
![Chemical structure of (3S)-3-[1-oxo-5-(piperazin-1-yl)-2,3-dihydro-1H-isoindol-2-yl]piperidine-2,6-dione - CSSB03619048240](/st/structure/200/ad3d0288629c2f00a923343022ac82c4/O%253DC1N%2528Cc2cc%2528ccc12%2529N1CCNCC1%2529%255BC%2540H%255D1CCC%2528%253DO%2529NC1%253DO.png)
![Chemical structure of 3-{5-[4-(4-hydroxybenzoyl)piperazin-1-yl]-1-oxo-2,3-dihydro-1H-isoindol-2-yl}piperidine-2,6-dione - CSSB21531607614](/st/structure/200/71e90e6d2bf966f74cbf5bb576e7372c/OC1%253DCC%253DC%2528C%253DC1%2529C%2528%253DO%2529N1CCN%2528CC1%2529C1%253DCC%253DC2C%2528CN%2528C3CCC%2528%253DO%2529NC3%253DO%2529C2%253DO%2529%253DC1.png)
