(3S)-1-azabicyclo[2.2.2]octan-3-yl (1R)-1-phenyl-1,2,3,4-tetrahydroisoquinoline-2-carboxylate
Structure Info
- Chemspace ID
- CSSB00025774142 (In-Stock Building Blocks)
- CAS
- 774517-20-3
- MFCD
- MFCD28411493
- IUPAC Name
- (3S)-1-azabicyclo[2.2.2]octan-3-yl (1R)-1-phenyl-1,2,3,4-tetrahydroisoquinoline-2-carboxylate
- Mol formula
- C23H26N2O2
- Mol weight
- 362 Da
- Catalog Number(s)
- 774517-20-3, AA01B7CN, AG01B7FF, AKOS040918206, APB774517203, BUP14108, CSC025774142, EBC-12996, EN300-310970, HY-79579, S5238, TX01B8L3, TYD-08955, Y3315254, Z2327235643
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- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.96
- Heavy atoms count
- 27
- Rotatable bond count
- 3
- Number of rings
- 5
- Carbon bond saturation, Fsp3
- 0.434
- Polar surface area (Å)
- 33
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
![Chemical structure of (3S)-1-azabicyclo[2.2.2]octan-3-yl (1R)-1-phenyl-1,2,3,4-tetrahydroisoquinoline-2-carboxylate (C23H26N2O2) - CSSB00025774142](/st/structure/200/1edc909d77dce31b8ec67ee3817bcd1f/O%253DC%2528O%255BC%2540%2540H%255D1CN2CCC1CC2%2529N1CCC2%253DCC%253DCC%253DC2%255BC%2540H%255D1C1%253DCC%253DCC%253DC1.png "C23H26N2O2")
- Zoom the structure
- CSSB00025774142
Items Overall 3 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| eNovation CN | 20 days | China To: | 98 | 10 mg | 879.75 | |
| eNovation CN | 20 days | China To: | 98 | 25 mg | 1,506.50 | |
| eNovation CN | 20 days | China To: | 98 | 100 mg | 2,507.00 | |
Description: (1R,3'S)-Solifenacin; CAS: 774517-20-3 | ||||||
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Substructure Analogs
![Chemical structure of (1S,3S,4s)-1-azabicyclo[2.2.2]octan-3-yl (1R)-1-phenyl-1,2,3,4-tetrahydroisoquinoline-2-carboxylate hydrochloride - CSSB00159250140](/st/structure/200/ca79935e6bcade6c8604d06a25b94bad/Cl.O%253DC%2528O%255BC%2540%2540H%255D1C%255BN%2540%2540%255D2CC%255BC%2540H%255D1CC2%2529N1CCC2%253DCC%253DCC%253DC2%255BC%2540H%255D1C1%253DCC%253DCC%253DC1.png)
![Chemical structure of (3S)-1-azabicyclo[2.2.2]octan-3-yl (1R)-1-phenyl-1,2,3,4-tetrahydroisoquinoline-2-carboxylate; butanedioic acid - CSSB14948337004](/st/structure/200/9f39879a5fe8cb41dd3d0948cbd2b4df/OC%2528%253DO%2529CCC%2528O%2529%253DO.O%253DC%2528O%255BC%2540%2540H%255D1CN2CCC1CC2%2529N1CCC2%253DCC%253DCC%253DC2%255BC%2540H%255D1C1%253DCC%253DCC%253DC1.png)
Similarity Analogs
![Chemical structure of 1-azabicyclo[2.2.2]octan-3-yl 1-phenyl-1,2,3,4-tetrahydroisoquinoline-2-carboxylate - CSSB00102523311](/st/structure/200/1dcaa8d6dbac828b8796971706f27117/O%253DC%2528OC1CN2CCC1CC2%2529N1CCC2%253DCC%253DCC%253DC2C1C1%253DCC%253DCC%253DC1.png)
![Chemical structure of (3R)-1-azabicyclo[2.2.2]octan-3-yl 1-phenyl-1,2,3,4-tetrahydroisoquinoline-2-carboxylate - CSSB00138412639](/st/structure/200/858b4ac2e19ffe2d4ffed1346ec92f94/O%253DC%2528O%255BC%2540H%255D1CN2CCC1CC2%2529N1CCC2%253DCC%253DCC%253DC2C1C1%253DCC%253DCC%253DC1.png)
![Chemical structure of (3R)-1-azabicyclo[2.2.2]octan-3-yl (1S)-1-phenyl-1,2,3,4-tetrahydroisoquinoline-2-carboxylate - CSSB00116206880](/st/structure/200/5d5b7e42e1e61a748f7f831bcfe4cd7f/O%253DC%2528O%255BC%2540H%255D1CN2CCC1CC2%2529N1CCC2%253DCC%253DCC%253DC2%255BC%2540%2540H%255D1C1%253DCC%253DCC%253DC1.png)
![Chemical structure of (3S)-1-azabicyclo[2.2.2]octan-3-yl (1S)-1-phenyl-1,2,3,4-tetrahydroisoquinoline-2-carboxylate hydrochloride - CSSB00138440319](/st/structure/200/770e8495e782cc9c1afc2e8ee6d48673/Cl.O%253DC%2528O%255BC%2540%2540H%255D1CN2CCC1CC2%2529N1CCC2%253DCC%253DCC%253DC2%255BC%2540%2540H%255D1C1%253DCC%253DCC%253DC1.png)
![Chemical structure of 1-azabicyclo[2.2.2]octan-3-yl 1-phenyl-1,2,3,4-tetrahydroisoquinoline-2-carboxylate hydrochloride - CSSB00159267966](/st/structure/200/c7e76f60fa4cb53857ee16120f10ca5b/Cl.O%253DC%2528OC1CN2CCC1CC2%2529N1CCC2%253DCC%253DCC%253DC2C1C1%253DCC%253DCC%253DC1.png)
![Chemical structure of (3R)-1-azabicyclo[2.2.2]octan-3-yl (1S)-1-phenyl-1,2,3,4-tetrahydroisoquinoline-2-carboxylate hydrochloride - CSSB00020619298](/st/structure/200/fc1920840d7cb58d2e2142826e0da8f7/Cl.O%253DC%2528O%255BC%2540H%255D1CN2CC%255BC%2540H%255D1CC2%2529N1CCC2%253DCC%253DCC%253DC2%255BC%2540%2540H%255D1C1%253DCC%253DCC%253DC1.png)
