N-butyl-2-{5-hydroxy-3-methyl-4-[(4-methylphenyl)methyl]-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
N-butyl-2-{5-hydroxy-3-methyl-4-[(4-methylphenyl)methyl]-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxamide
N-butyl-2-{5-hydroxy-3-methyl-4-[(4-methylphenyl)methyl]-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | D475-2045 |
| Compound Name: | N-butyl-2-{5-hydroxy-3-methyl-4-[(4-methylphenyl)methyl]-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 398.53 |
| Molecular Formula: | C21 H26 N4 O2 S |
| Smiles: | [H]C([H])(c1ccc(C)cc1)c1c(C)nn(c1O)c1nc(C)c(C(NCCCC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.2577 |
| logD: | 2.8479 |
| logSw: | -4.0333 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.74 |
| InChI Key: | BQYQZULWVCINIX-UHFFFAOYSA-N |