3-[di(prop-2-en-1-yl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
3-[di(prop-2-en-1-yl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid
3-[di(prop-2-en-1-yl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-8296 |
| Compound Name: | 3-[di(prop-2-en-1-yl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 249.27 |
| Molecular Formula: | C12 H15 N3 O3 |
| Smiles: | Cn1cc(C(O)=O)c(C(N(CC=C)CC=C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.7399 |
| logD: | -2.8349 |
| logSw: | -1.2214 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.442 |
| InChI Key: | BPLKUYNJRIUYJO-UHFFFAOYSA-N |