2-[3,5-dimethyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
2-[3,5-dimethyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide
2-[3,5-dimethyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | D314-0550 |
| Compound Name: | 2-[3,5-dimethyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 382.53 |
| Molecular Formula: | C21 H26 N4 O S |
| Smiles: | CC(C)CCc1c(C)nn(c1C)c1nc(C)c(C(Nc2ccccc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.8978 |
| logD: | 4.8975 |
| logSw: | -4.5053 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.145 |
| InChI Key: | HXLLRLCYKSOPJN-UHFFFAOYSA-N |