4-(3-ethynylbenzoyl)-10,10-dimethyl-3λ⁶-thia-4-azatricyclo[5.2.1.0¹,⁵]decane-3,3-dione
Structure Info
- Chemspace ID
- CSSB21531608436 (In-Stock Building Blocks)
- IUPAC Name
- 4-(3-ethynylbenzoyl)-10,10-dimethyl-3λ⁶-thia-4-azatricyclo[5.2.1.0¹,⁵]decane-3,3-dione
- Mol formula
- C19H21NO3S
- Mol weight
- 343 Da
- Catalog Number(s)
- ACNTOW578
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.58
- Heavy atoms count
- 24
- Rotatable bond count
- 1
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.526
- Polar surface area (Å)
- 54
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
![Chemical structure of 4-(3-ethynylbenzoyl)-10,10-dimethyl-3λ⁶-thia-4-azatricyclo[5.2.1.0¹,⁵]decane-3,3-dione (C19H21NO3S) - CSSB21531608436](/st/structure/200/0d0fb8dde7d09069334036b03412d379/CC1%2528C%2529C2CCC11CS%2528%253DO%2529%2528%253DO%2529N%2528C1C2%2529C%2528%253DO%2529C1%253DCC%253DCC%2528%253DC1%2529C%2523C.png "C19H21NO3S")
- Zoom the structure
- CSSB21531608436
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 | 358.00 | |
| AiFChem CN | 10 days | China To: | 95 | 250 mg | 715.00 | |
| AiFChem CN | 10 days | China To: | 95 | 1 g | 1,285.00 | |
Description: (8,8-dimethyl-2,2-dioxidotetrahydro-3H-3a,6-methanobenzo[c]isothiazol-1(4H)-yl)(3-ethynylphenyl)methanone | ||||||
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