3-[(3S)-2-oxooxolan-3-yl]-1-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
Structure Info
- Chemspace ID
- CSSB21245997292 (In-Stock Building Blocks)
- IUPAC Name
- 3-[(3S)-2-oxooxolan-3-yl]-1-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
- Mol formula
- C17H23BN2O5
- Mol weight
- 346 Da
- Catalog Number(s)
- BBLS21245997292, BBV-2099951171, EN300-54940933, bbls21245997292
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.84
- Heavy atoms count
- 25
- Rotatable bond count
- 3
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.529
- Polar surface area (Å)
- 86
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 2
![Chemical structure of 3-[(3S)-2-oxooxolan-3-yl]-1-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea (C17H23BN2O5) - CSSB21245997292](/st/structure/200/34b3cd3741b0bdb57169b12c14cc2dfb/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DCC%2528NC%2528%253DO%2529N%255BC%2540H%255D2CCOC2%253DO%2529%253DCC%253DC1.png "C17H23BN2O5")
- Zoom the structure
- CSSB21245997292
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 | 455.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 477.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 498.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 519.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 541.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 1,063.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 1,572.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 2,331.00 |
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Substructure Analogs
![Chemical structure of 1-[2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-[(3S)-2-oxooxolan-3-yl]urea - CSSB21245997207](/st/structure/200/7cf20899f3fd612281cafb9a53396dff/CC1%253DC%2528NC%2528%253DO%2529N%255BC%2540H%255D2CCOC2%253DO%2529C%253DC%2528C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
![Chemical structure of 1-[2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-[(3S)-2-oxooxolan-3-yl]urea - CSSB21245997086](/st/structure/200/06d781340cc59e690cca5fe9bb47c237/CC1%253DC%2528C%253DCC%253DC1NC%2528%253DO%2529N%255BC%2540H%255D1CCOC1%253DO%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
![Chemical structure of 1-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-[(3S)-2-oxooxolan-3-yl]urea - CSSB21245996886](/st/structure/200/937e84160bc6838935d09baa5f6bd92a/CC1%253DC%2528C%253DC%2528NC%2528%253DO%2529N%255BC%2540H%255D2CCOC2%253DO%2529C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
![Chemical structure of 1-[2-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-[(3S)-2-oxooxolan-3-yl]urea - CSSB21245996647](/st/structure/200/1aeac7ce18d36a69f4067c731839851e/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DC%2528F%2529C%2528NC%2528%253DO%2529N%255BC%2540H%255D2CCOC2%253DO%2529%253DCC%253DC1.png)
![Chemical structure of 1-[2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-[(3S)-2-oxooxolan-3-yl]urea - CSSB21245996637](/st/structure/200/5b37003fd2eca4cc94f4fc64a4e23604/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DCC%2528NC%2528%253DO%2529N%255BC%2540H%255D2CCOC2%253DO%2529%253DC%2528F%2529C%253DC1.png)
![Chemical structure of 1-[2-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-[(3S)-2-oxooxolan-3-yl]urea - CSSB21245995214](/st/structure/200/199494f86991774e9430cc50a242726a/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DC%2528Cl%2529C%2528NC%2528%253DO%2529N%255BC%2540H%255D2CCOC2%253DO%2529%253DCC%253DC1.png)
![Chemical structure of 1-[3-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-[(3S)-2-oxooxolan-3-yl]urea - CSSB21245996546](/st/structure/200/bce04aa073ee54d14ab3226cc7cd950c/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DCC%2528NC%2528%253DO%2529N%255BC%2540H%255D2CCOC2%253DO%2529%253DCC%2528Cl%2529%253DC1.png)
Similarity Analogs
![Chemical structure of 3-[(3S)-2-oxooxolan-3-yl]-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21245997734](/st/structure/200/58e80b9f6d8b900747ebf28b0e78857e/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DCC%253DC%2528NC%2528%253DO%2529N%255BC%2540H%255D2CCOC2%253DO%2529C%253DC1.png)
![Chemical structure of 1-[2-fluoro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-[(3S)-2-oxooxolan-3-yl]urea - CSSB21245995871](/st/structure/200/8e58508a237763fd5899d3ada7f15e84/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DC%2528NC%2528%253DO%2529N%255BC%2540H%255D2CCOC2%253DO%2529C%2528F%2529%253DCC%253DC1.png)
![Chemical structure of 1-[3-(difluoromethoxy)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-[(3S)-2-oxooxolan-3-yl]urea - CSSB21332059400](/st/structure/200/5a63ff6f4eaced7b127bd59a10657d57/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DCC%2528OC%2528F%2529F%2529%253DCC%2528NC%2528%253DO%2529N%255BC%2540H%255D2CCOC2%253DO%2529%253DC1.png)
