Tert-butyl 4-benzyl-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate
Structure Info
- Chemspace ID
- CSSB00010363571 (In-Stock Building Blocks)
- CAS
- 1358783-18-2
- MFCD
- MFCD24447815, MFCD31579922, MFCD31579932, MFCD31706242
- IUPAC Name
- tert-butyl 4-benzyl-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate
- Mol formula
- C18H26N2O3
- Mol weight
- 318 Da
- Catalog Number(s)
- 171083, A109006916, AA00HUBW, AA01DTH4, AC044996, AG00HUEO, AG01DTJW, AG152398, AGNPC-0WBRIB, AI32360, AX24244, B750718, BBLS00010363571, BBV-45210399, BD301453, CD11279495, CM326451, CP007373, CS-0171739, CSC010363571, D499906, D916548, F504047, HY-W114046, I-9380, IEC78318, JPM2-00-8339, NFA02692, NFA02701, OR1022429, P13934, P13934-0.25G, PBXA8045, SAB-088237, SAB-109437, ST01DV0O, SY098059, TX00HVKC, TX01DUPK, TX01DUPL, Y53313, bbls00010363571
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- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.56
- Heavy atoms count
- 23
- Rotatable bond count
- 4
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.61111111111111
- Polar surface area (Å)
- 42
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
![Chemical structure of Tert-butyl 4-benzyl-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate (C18H26N2O3) - CSSB00010363571](/st/structure/200/b502b5bf765ef39cc21c594cc9a0df6f/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC2OCCN%2528CC3%253DCC%253DCC%253DC3%2529C2C1.png "C18H26N2O3")
- Zoom the structure
- CSSB00010363571
Items Overall 21 items from 7 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific LLC | 3 days | United States To: | 95 | 250 mg | 124.30 | |
| 1st Scientific LLC | 3 days | United States To: | 95 | 1 g | 330.00 | |
| 1st Scientific LLC | 3 days | United States To: | 95 | 5 g | 952.60 | |
Description: Pyrrolo[3,4-b]-1,4-oxazine-6(2H)-carboxylic acid,hexahydro-4-(phenylmethyl)-, 1,1-dimethylethyl ester, trans-; CAS: 138026-92-3 | ||||||
| Angene US | 10 days | United States To: | 95 | 250 mg | 148.50 | |
| Angene US | 10 days | United States To: | 95 | 1 g | 389.70 | |
| Angene US | 10 days | United States To: | 95 | 5 g | 1,116.90 | |
Description: CAS: 138026-92-3 | ||||||
| A2B Chem | 12 days | United States To: | 95 | 250 mg | 157.55 | |
| A2B Chem | 12 days | United States To: | 95 | 1 g | 396.75 | |
| A2B Chem | 12 days | United States To: | 95 | 5 g | 1,120.10 | |
Description: CAS: 138026-92-3 | ||||||
| AA BLOCKS | 12 days | United States To: | 95 | 250 mg | 163.90 | |
| AA BLOCKS | 12 days | United States To: | 95 | 1 g | 418.00 | |
| AA BLOCKS | 12 days | United States To: | 95 | 5 g | 1,186.90 | |
Description: CAS: 138026-92-3 | ||||||
| BB4LS GS | 15 days | Germany To: | 95 | 50 umol | 104.78 | |
| BB4LS GS | 15 days | Germany To: | 95 | 100 umol | 106.72 | |
| BB4LS GS | 15 days | Germany To: | 95 | 200 umol | 108.66 | |
| BB4LS GS | 15 days | Germany To: | 95 | 300 umol | 110.60 | |
| BB4LS GS | 15 days | Germany To: | 95 | 500 umol | 112.54 | |
| Chemenu Inc. | 24 days | China To: | 95 | 1 g | 513.70 | |
Description: CAS: 1358783-18-2 | ||||||
| 10X CHEM | TBD | United States To: | 95 | 250 mg | 107.80 | |
| 10X CHEM | TBD | United States To: | 95 | 1 g | 311.30 | |
| 10X CHEM | TBD | United States To: | 95 | 5 g | 927.30 | |
Description: Pyrrolo[3,4-b]-1,4-oxazine-6(2H)-carboxylic acid,hexahydro-4-(phenylmethyl)-, 1,1-dimethylethyl ester, trans-; CAS: 138026-92-3 | ||||||
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Substructure Analogs
![Chemical structure of rac-tert-butyl (4aR,7aS)-4-benzyl-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate - CSSB20620668170](/st/structure/200/918e0abdf742f5d5ea87d244561a353a/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540H%255D2OCCN%2528CC3%253DCC%253DCC%253DC3%2529%255BC%2540H%255D2C1%2B%257C%25261%253A9%252C21%252Cr%257C.png)
![Chemical structure of tert-butyl (4aR,7aR)-4-benzyl-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate - CSSB00119594600](/st/structure/200/47906ee690e32fb212612b4f8d340e1a/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540H%255D2OCCN%2528CC3%253DCC%253DCC%253DC3%2529%255BC%2540%2540H%255D2C1.png)
Similarity Analogs
![Chemical structure of tert-butyl 1-benzyl-octahydropyrrolo[3,4-b]pyrrole-5-carboxylate - CSSB00000064724](/st/structure/200/cc7b26ef88e48724bc3e811d95262580/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC2CCN%2528CC3%253DCC%253DCC%253DC3%2529C2C1.png)
![Chemical structure of tert-butyl 6-(dibenzylamino)-3-azabicyclo[3.1.0]hexane-3-carboxylate - CSSB00016196886](/st/structure/200/6c9d739cd03c4d30d757e566fd812dfe/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC2C%2528C1%2529C2N%2528CC1%253DCC%253DCC%253DC1%2529CC1%253DCC%253DCC%253DC1.png)
![Chemical structure of tert-butyl (1R,5S)-6-(dibenzylamino)-3-azabicyclo[3.1.0]hexane-3-carboxylate - CSSB14929130751](/st/structure/200/a05d8d7775cb5b2af32e9498baa0e91f/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540H%255D2%255BC%2540%2540H%255D%2528C1%2529C2N%2528Cc1ccccc1%2529Cc1ccccc1.png)
