4-({[(1-methyl-1H-pyrazol-3-yl)methyl]amino}methyl)benzoic acid hydrochloride
Structure Info
- Chemspace ID
- CSSB00025717979 (In-Stock Building Blocks)
- IUPAC Name
- 4-({[(1-methyl-1H-pyrazol-3-yl)methyl]amino}methyl)benzoic acid hydrochloride
- Mol formula
- C13H16ClN3O2
- Mol weight
- 282 Da
- Catalog Number(s)
- B037962, CSC025717979, F478669, OSSL_773741
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.98
- Heavy atoms count
- 19
- Rotatable bond count
- 5
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.23
- Polar surface area (Å)
- 67
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 2
![Chemical structure of 4-({[(1-methyl-1H-pyrazol-3-yl)methyl]amino}methyl)benzoic acid hydrochloride (C13H16ClN3O2) - CSSB00025717979](/st/structure/200/1968d8cd65c3a5cc253ccdb24ac3da26/Cl.CN1C%253DCC%2528CNCC2%253DCC%253DC%2528C%253DC2%2529C%2528O%2529%253DO%2529%253DN1.png "C13H16ClN3O2")
- Zoom the structure
- CSSB00025717979
Items Overall 1 item from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Fluorochem | 12 days | Ireland To: | 90 | 250 mg | 475.00 | |
Description: 4-{[(1-Methyl-1H-pyrazol-3-ylmethyl)-amino]-methyl}-benzoic acid; hydrochloride; ; Storage Conditions: ambient storage; Hazard Codes: H302, H315, H319, H335; GHS Pictograms: GHS07 | ||||||
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Substructure Analogs
![Chemical structure of 4-[(N-benzyl-1-{8-chloro-1-methyl-1H,4H-chromeno[4,3-c]pyrazol-3-yl}formamido)methyl]benzoic acid - CSSB00103150521](/st/structure/200/91f18b76ec8470e1c5d7f121de4c8144/CN1N%253DC%2528C%2528%253DO%2529N%2528CC2%253DCC%253DCC%253DC2%2529CC2%253DCC%253DC%2528C%253DC2%2529C%2528O%2529%253DO%2529C2%253DC1C1%253DCC%2528Cl%2529%253DCC%253DC1OC2.png)
Similarity Analogs
![Chemical structure of 4-({[(1-methyl-1H-pyrazol-3-yl)methyl]amino}methyl)benzoic acid - CSSB00008317331](/st/structure/200/bc1165d10316a322b7a5b066fbdc301b/CN1C%253DCC%2528CNCC2%253DCC%253DC%2528C%253DC2%2529C%2528O%2529%253DO%2529%253DN1.png)
![Chemical structure of 4-{[(1-methyl-1H-pyrazol-3-yl)methyl]amino}benzoic acid - CSSB00006008838](/st/structure/200/7fa24194b786d811be43343afb6126e8/CN1C%253DCC%2528CNC2%253DCC%253DC%2528C%253DC2%2529C%2528O%2529%253DO%2529%253DN1.png)
![Chemical structure of 4-({[(1-ethyl-1H-pyrazol-3-yl)methyl]amino}methyl)benzoic acid - CSSB00025717714](/st/structure/200/8fded3bdf3b067fb01cb82b3ac2987ad/CCN1C%253DCC%2528CNCC2%253DCC%253DC%2528C%253DC2%2529C%2528O%2529%253DO%2529%253DN1.png)
![Chemical structure of 2-({[(1-methyl-1H-pyrazol-3-yl)methyl]amino}methyl)benzoic acid - CSSB00004676398](/st/structure/200/e8288a732edc759ffbeacdad7eb9815d/CN1C%253DCC%2528CNCC2%253DCC%253DCC%253DC2C%2528O%2529%253DO%2529%253DN1.png)
![Chemical structure of methyl 4-({[(1-methyl-1H-pyrazol-3-yl)methyl]amino}methyl)benzoate - CSSB00008317939](/st/structure/200/66fe6c9b361fa9fd5950fc1d5d78ced2/COC%2528%253DO%2529C1%253DCC%253DC%2528CNCC2%253DNN%2528C%2529C%253DC2%2529C%253DC1.png)
![Chemical structure of [(4-ethoxyphenyl)methyl][(1-methyl-1H-pyrazol-3-yl)methyl]amine - CSSB00008055531](/st/structure/200/1000d559f30a32de604b25289a416e8b/CCOC1%253DCC%253DC%2528CNCC2%253DNN%2528C%2529C%253DC2%2529C%253DC1.png)
![Chemical structure of 4-({[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]amino}methyl)benzoic acid - CSSB00003676644](/st/structure/200/b50c09d76151ecaa5e286c26be720895/CN1C%253DC%2528CNCC2%253DCC%253DC%2528C%253DC2%2529C%2528O%2529%253DO%2529C%2528C%2529%253DN1.png)
