5-methyl-4-[(3-methyl-4,5-dihydro-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carboxylic acid--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-methyl-4-[(3-methyl-4,5-dihydro-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carboxylic acid--hydrogen chloride (1/1)
5-methyl-4-[(3-methyl-4,5-dihydro-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carboxylic acid--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | Y700-0943 |
| Compound Name: | 5-methyl-4-[(3-methyl-4,5-dihydro-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carboxylic acid--hydrogen chloride (1/1) |
| Molecular Weight: | 259.69 |
| Molecular Formula: | C10 H13 N3 O3 |
| Salt: | HCl |
| Smiles: | CC1CCN(Cc2c(C(O)=O)noc2C)N=1 |
| Stereo: | ACHIRAL |
| logP: | 0.695 |
| logD: | -2.708 |
| logSw: | -0.2224 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.541 |
| InChI Key: | ZDJSHWWUJHJKLZ-UHFFFAOYSA-N |