Tert-butyl 2-(1-hydroxyprop-2-en-1-yl)-4H,5H,6H,7H,8H-[1,3]thiazolo[4,5-d]azepine-6-carboxylate
Structure Info
- Chemspace ID
- CSSB20776014096 (In-Stock Building Blocks)
- IUPAC Name
- tert-butyl 2-(1-hydroxyprop-2-en-1-yl)-4H,5H,6H,7H,8H-[1,3]thiazolo[4,5-d]azepine-6-carboxylate
- Mol formula
- C15H22N2O3S
- Mol weight
- 310 Da
- Catalog Number(s)
- BBLS20776014096, BBV-1652397789, EN300-54715914, bbls20776014096
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.21
- Heavy atoms count
- 21
- Rotatable bond count
- 4
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.6
- Polar surface area (Å)
- 63
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
![Chemical structure of Tert-butyl 2-(1-hydroxyprop-2-en-1-yl)-4H,5H,6H,7H,8H-[1,3]thiazolo[4,5-d]azepine-6-carboxylate (C15H22N2O3S) - CSSB20776014096](/st/structure/200/150958baf02990ed93043d2cec8dbfbf/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CCC2%253DC%2528CC1%2529N%253DC%2528S2%2529C%2528O%2529C%253DC.png "C15H22N2O3S")
- Zoom the structure
- CSSB20776014096
Items Overall 8 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 50 mg | 935.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 979.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 1,024.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 1,068.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 1,113.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 2,185.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 3,231.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 4,791.00 |
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Substructure Analogs
![Chemical structure of tert-butyl 2-(1-hydroxy-2-methylprop-2-en-1-yl)-4H,5H,6H,7H,8H-[1,3]thiazolo[4,5-d]azepine-6-carboxylate - CSSB20775855775](/st/structure/200/b34ddf126d8d380d083bf3855872106c/CC%2528%253DC%2529C%2528O%2529C1%253DNC2%253DC%2528CCN%2528CC2%2529C%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529S1.png)
Similarity Analogs
![Chemical structure of tert-butyl 2-(1-hydroxybut-3-en-1-yl)-4H,5H,6H,7H,8H-[1,3]thiazolo[4,5-d]azepine-6-carboxylate - CSSB20776014098](/st/structure/200/41a7c7edb72e4746e89cb4ed5c55ae69/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CCC2%253DC%2528CC1%2529N%253DC%2528S2%2529C%2528O%2529CC%253DC.png)
![Chemical structure of tert-butyl 2-(1-hydroxyethyl)-4H,5H,6H,7H,8H-[1,3]thiazolo[4,5-d]azepine-6-carboxylate - CSSB20776014095](/st/structure/200/f46bd5c52bdc85bdbaf5a8c55dfcc0da/CC%2528O%2529C1%253DNC2%253DC%2528CCN%2528CC2%2529C%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529S1.png)
![Chemical structure of tert-butyl 2-(1-hydroxyprop-2-yn-1-yl)-4H,5H,6H,7H,8H-[1,3]thiazolo[4,5-d]azepine-6-carboxylate - CSSB20775855772](/st/structure/200/56203099e9b8ae2c388046dcf3a4ea6f/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CCC2%253DC%2528CC1%2529N%253DC%2528S2%2529C%2528O%2529C%2523C.png)
![Chemical structure of tert-butyl 2-(1-hydroxypropyl)-4H,5H,6H,7H,8H-[1,3]thiazolo[4,5-d]azepine-6-carboxylate - CSSB20775855773](/st/structure/200/f8e29dcd0864bf066f6fd2ac485c37bb/CCC%2528O%2529C1%253DNC2%253DC%2528CCN%2528CC2%2529C%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529S1.png)
![Chemical structure of tert-butyl 2-(1-hydroxy-2-methylpropyl)-4H,5H,6H,7H,8H-[1,3]thiazolo[4,5-d]azepine-6-carboxylate - CSSB20775855776](/st/structure/200/1b8d74a7397272f68fff42ec13c8bd5f/CC%2528C%2529C%2528O%2529C1%253DNC2%253DC%2528CCN%2528CC2%2529C%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529S1.png)
![Chemical structure of tert-butyl 2-(1-hydroxyprop-2-en-1-yl)-4H,5H,6H,7H-thieno[2,3-c]pyridine-6-carboxylate - CSSB14971121950](/st/structure/200/b4d0ef49168bce38bd1285a48bb010db/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CCC2%253DC%2528C1%2529SC%2528%253DC2%2529C%2528O%2529C%253DC.png)
