4-{[(tert-butoxy)carbonyl]amino}-1-ethyl-1H-pyrazole-5-carboxylic acid
Structure Info
- Chemspace ID
- CSSB00116215531 (In-Stock Building Blocks)
- CAS
- 2248416-55-7
- MFCD
- MFCD35434719, MFCD35434719
- IUPAC Name
- 4-{[(tert-butoxy)carbonyl]amino}-1-ethyl-1H-pyrazole-5-carboxylic acid
- Mol formula
- C11H17N3O4
- Mol weight
- 255 Da
- Catalog Number(s)
- BBLS00116215531, BBV-159230189, BD02764880, CSC116215531, EN300-6509476, JS63527, TX0F1IRV, ZX-NM314339, bbls00116215531
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.25
- Heavy atoms count
- 18
- Rotatable bond count
- 5
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.545
- Polar surface area (Å)
- 93
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 2
![Chemical structure of 4-{[(tert-butoxy)carbonyl]amino}-1-ethyl-1H-pyrazole-5-carboxylic acid (C11H17N3O4) - CSSB00116215531](/st/structure/200/74827eaba37db354082edfd0296a8fa8/CCN1N%253DCC%2528NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529%253DC1C%2528O%2529%253DO.png "C11H17N3O4")
- Zoom the structure
- CSSB00116215531
Items Overall 24 items from 4 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| BB4LS US | 2 days | United States To: | 95 | 50 umol | 102.20 | |
| BB4LS US | 2 days | United States To: | 95 | 100 umol | 141.73 | |
| BB4LS US | 2 days | United States To: | 95 | 200 umol | 189.00 | |
| BB4LS US | 2 days | United States To: | 95 | 300 umol | 246.00 | |
| BB4LS US | 2 days | United States To: | 95 | 500 umol | 307.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 186.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 277.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 396.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 624.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 800.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 2.5 g | 1,568.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 5 g | 2,318.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 10 g | 3,438.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 186.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 277.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 396.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 624.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 1 g | 800.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 2.5 g | 1,568.00 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 50 umol | 102.20 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 100 umol | 141.73 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 200 umol | 189.00 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 300 umol | 246.00 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 500 umol | 307.00 |
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Substructure Analogs
![Chemical structure of 4-{[(tert-butoxy)carbonyl]amino}-1-ethyl-3-methyl-1H-pyrazole-5-carboxylic acid - CSSB00116215202](/st/structure/200/b10f499137ef13099663607057efa081/CCN1N%253DC%2528C%2529C%2528NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529%253DC1C%2528O%2529%253DO.png)
![Chemical structure of methyl 1-(2-bromoethyl)-4-{[(tert-butoxy)carbonyl]amino}-1H-pyrazole-5-carboxylate - CSSB00161107235](/st/structure/200/c3b49744cb0ef2b11d5a59aacb500aaf/COC%2528%253DO%2529C1%253DC%2528NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529C%253DNN1CCBr.png)