3-[bis(2-methylpropyl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
3-[bis(2-methylpropyl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid
3-[bis(2-methylpropyl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-8297 |
| Compound Name: | 3-[bis(2-methylpropyl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 281.35 |
| Molecular Formula: | C14 H23 N3 O3 |
| Smiles: | CC(C)CN(CC(C)C)C(c1c(cn(C)n1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1177 |
| logD: | -1.457 |
| logSw: | -1.9709 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.485 |
| InChI Key: | HDOARMKHGGGJKK-UHFFFAOYSA-N |