5-(4-{[(tert-butoxy)carbonyl]amino}phenyl)-1-methyl-1H-pyrazole-4-carboxylic acid
Structure Info
- Chemspace ID
- CSSB00103053621 (In-Stock Building Blocks)
- CAS
- 2228516-43-4
- MFCD
- MFCD36765919
- IUPAC Name
- 5-(4-{[(tert-butoxy)carbonyl]amino}phenyl)-1-methyl-1H-pyrazole-4-carboxylic acid
- Mol formula
- C16H19N3O4
- Mol weight
- 317 Da
- Catalog Number(s)
- AR02DZ42, BBV-137252065, CSC103053621, EC02E0KU, EN300-1878404, IMED3271504078, ST02DZVU, s_271570____21596386____24860412
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- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.54
- Heavy atoms count
- 23
- Rotatable bond count
- 5
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.312
- Polar surface area (Å)
- 93
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 2
![Chemical structure of 5-(4-{[(tert-butoxy)carbonyl]amino}phenyl)-1-methyl-1H-pyrazole-4-carboxylic acid (C16H19N3O4) - CSSB00103053621](/st/structure/200/febd60271a0102c8720bf7ee83fcb7f7/CN1N%253DCC%2528C%2528O%2529%253DO%2529%253DC1C1%253DCC%253DC%2528NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529C%253DC1.png "C16H19N3O4")
- Zoom the structure
- CSSB00103053621
Items Overall 3 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Accel Scientific, S.L. | 20 days | China To: | 95 | 100 mg | 584.10 | |
| Accel Scientific, S.L. | 20 days | China To: | 95 | 250 mg | 768.90 | |
| Accel Scientific, S.L. | 20 days | China To: | 95 | 1 g | 1,505.90 | |
Description: 5-(4-{[(tert-butoxy)carbonyl]amino}phenyl)-1-methyl-1H-pyrazole-4-carboxylic acid; CAS: 2228516-43-4 | ||||||
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Substructure Analogs
![Chemical structure of 5-(4-{[(tert-butoxy)carbonyl]amino}-3-methylphenyl)-1-methyl-1H-pyrazole-4-carboxylic acid - CSSB00103058800](/st/structure/200/39b20165c24b2dd7eaba39d710b0c7c2/CN1N%253DCC%2528C%2528O%2529%253DO%2529%253DC1C1%253DCC%253DC%2528NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529C%2528C%2529%253DC1.png)
![Chemical structure of 5-(4-{[(tert-butoxy)carbonyl]amino}-2-fluorophenyl)-1-methyl-1H-pyrazole-4-carboxylic acid - CSSB00103071581](/st/structure/200/4d184e7aac4e82cca0fed572031a24ac/CN1N%253DCC%2528C%2528O%2529%253DO%2529%253DC1C1%253DCC%253DC%2528NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529C%253DC1F.png)
![Chemical structure of ethyl 5-(4-{[(tert-butoxy)carbonyl]amino}phenyl)-1-methyl-1H-pyrazole-4-carboxylate - CSSB06583817290](/st/structure/200/59676c61e2c09e6bf74ea2bfcfee1e40/CCOC%2528%253DO%2529C1%253DC%2528C2%253DCC%253DC%2528NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529C%253DC2%2529N%2528C%2529N%253DC1.png)
![Chemical structure of 5-(4-{[(tert-butoxy)carbonyl]amino}-2-methoxyphenyl)-1-methyl-1H-pyrazole-4-carboxylic acid - CSSB00103070868](/st/structure/200/9f08ca113fbc22f28bfc542d8bd5c4a9/COC1%253DCC%2528NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529%253DCC%253DC1C1%253DC%2528C%253DNN1C%2529C%2528O%2529%253DO.png)
![Chemical structure of 5-(4-{[(tert-butoxy)carbonyl]amino}-3-methoxyphenyl)-1-methyl-1H-pyrazole-4-carboxylic acid - CSSB00103072675](/st/structure/200/13cab904fab6d4c1c816c46ec71357c5/COC1%253DCC%2528%253DCC%253DC1NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529C1%253DC%2528C%253DNN1C%2529C%2528O%2529%253DO.png)
Similarity Analogs
![Chemical structure of 5-(3-{[(tert-butoxy)carbonyl]amino}phenyl)-1-methyl-1H-pyrazole-4-carboxylic acid - CSSB00103048943](/st/structure/200/7c2ff3462c06bfd253ec750a586d9ab1/CN1N%253DCC%2528C%2528O%2529%253DO%2529%253DC1C1%253DCC%253DCC%2528NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529%253DC1.png)
![Chemical structure of 5-(5-{[(tert-butoxy)carbonyl]amino}-2-fluorophenyl)-1-methyl-1H-pyrazole-4-carboxylic acid - CSSB00103065695](/st/structure/200/d17b54d7681db01b3b8978c9c0b78702/CN1N%253DCC%2528C%2528O%2529%253DO%2529%253DC1C1%253DCC%2528NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529%253DCC%253DC1F.png)
![Chemical structure of 5-(3-{[(tert-butoxy)carbonyl]amino}-4-methylphenyl)-1-methyl-1H-pyrazole-4-carboxylic acid - CSSB00103053365](/st/structure/200/dcc4aaddada03dd5859760065d1c7885/CN1N%253DCC%2528C%2528O%2529%253DO%2529%253DC1C1%253DCC%253DC%2528C%2529C%2528NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529%253DC1.png)
![Chemical structure of 5-(2-{[(tert-butoxy)carbonyl]amino}pyrimidin-5-yl)-1-methyl-1H-pyrazole-4-carboxylic acid - CSSB00103056234](/st/structure/200/9abba921f5fbca8a397cf096ebabb59f/CN1N%253DCC%2528C%2528O%2529%253DO%2529%253DC1C1%253DCN%253DC%2528NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529N%253DC1.png)
