3-(3,3-difluoropropyl)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)phenyl]urea
Structure Info
- Chemspace ID
- CSSB21332140454 (In-Stock Building Blocks)
- IUPAC Name
- 3-(3,3-difluoropropyl)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)phenyl]urea
- Mol formula
- C17H22BF5N2O3
- Mol weight
- 408 Da
- Catalog Number(s)
- BBLS21332140454, EN300-54981075, bbls21332140454
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.58
- Heavy atoms count
- 28
- Rotatable bond count
- 6
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.588
- Polar surface area (Å)
- 60
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 2
![Chemical structure of 3-(3,3-difluoropropyl)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)phenyl]urea (C17H22BF5N2O3) - CSSB21332140454](/st/structure/200/7327d3a19f513ee1e63407f3094e46ef/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DCC%2528%253DC%2528NC%2528%253DO%2529NCCC%2528F%2529F%2529C%253DC1%2529C%2528F%2529%2528F%2529F.png "C17H22BF5N2O3")
- Zoom the structure
- CSSB21332140454
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 | 707.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 741.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 776.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 809.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 842.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 1,650.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 2,443.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 3,622.00 |
For a custom pack size or bulk
please drop us a line:Enquire
please drop us a line:Enquire
Substructure Analogs
![Chemical structure of 3-(3,3-difluorocyclobutyl)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)phenyl]urea - CSSB21332138363](/st/structure/200/89bd57107a981aeb8d10a9fbbdf5e71a/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DCC%2528%253DC%2528NC%2528%253DO%2529NC2CC%2528F%2529%2528F%2529C2%2529C%253DC1%2529C%2528F%2529%2528F%2529F.png)
![Chemical structure of 1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)phenyl]-3-(3,3,3-trifluoropropyl)urea - CSSB21332058068](/st/structure/200/9b00b8d7d53cb43a68dfdb3d303c2b92/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DCC%2528%253DC%2528NC%2528%253DO%2529NCCC%2528F%2529%2528F%2529F%2529C%253DC1%2529C%2528F%2529%2528F%2529F.png)
Similarity Analogs
![Chemical structure of 3-(3-methylbutyl)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)phenyl]urea - CSSB21332114872](/st/structure/200/8c93ae325b29423fac68780873b8019f/CC%2528C%2529CCNC%2528%253DO%2529NC1%253DC%2528C%253DC%2528C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1%2529C%2528F%2529%2528F%2529F.png)
![Chemical structure of 3-(2-cyclobutylethyl)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)phenyl]urea - CSSB21332137916](/st/structure/200/912f8f993a23b329a31558060bbbe760/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DCC%2528%253DC%2528NC%2528%253DO%2529NCCC2CCC2%2529C%253DC1%2529C%2528F%2529%2528F%2529F.png)
![Chemical structure of 3-(2-cyclopentylethyl)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)phenyl]urea - CSSB21332058071](/st/structure/200/7b7bb4111c35690ed2987e3784b1c1ae/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DCC%2528%253DC%2528NC%2528%253DO%2529NCCC2CCCC2%2529C%253DC1%2529C%2528F%2529%2528F%2529F.png)
![Chemical structure of 3-(2,2-difluoroethyl)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)phenyl]urea - CSSB21332113599](/st/structure/200/ddd4dd87c5b7188dafedef8236d5299f/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DCC%2528%253DC%2528NC%2528%253DO%2529NCC%2528F%2529F%2529C%253DC1%2529C%2528F%2529%2528F%2529F.png)
![Chemical structure of 1-(2-cyclohexylethyl)-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)phenyl]urea - CSSB21332132137](/st/structure/200/86c1b518de92859fa10afa2325a4a3ce/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DCC%2528%253DC%2528NC%2528%253DO%2529NCCC2CCCCC2%2529C%253DC1%2529C%2528F%2529%2528F%2529F.png)
![Chemical structure of 3-[2-(2,2-difluoroethoxy)ethyl]-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)phenyl]urea - CSSB21332130501](/st/structure/200/961ba44b9c188cb03ff253adb232db67/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DCC%2528%253DC%2528NC%2528%253DO%2529NCCOCC%2528F%2529F%2529C%253DC1%2529C%2528F%2529%2528F%2529F.png)
![Chemical structure of 1-(4-cyclohexylbutyl)-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)phenyl]urea - CSSB21332121560](/st/structure/200/07bc25c22fd93067a157fa29c3e6dac3/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DCC%2528%253DC%2528NC%2528%253DO%2529NCCCCC2CCCCC2%2529C%253DC1%2529C%2528F%2529%2528F%2529F.png)
