2-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}-1,3-thiazolidine-4-carboxylic acid
Chemical Structure Depiction of
2-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}-1,3-thiazolidine-4-carboxylic acid
2-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}-1,3-thiazolidine-4-carboxylic acid
Compound characteristics
| Compound ID: | 8012-5186 |
| Compound Name: | 2-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}-1,3-thiazolidine-4-carboxylic acid |
| Molecular Weight: | 426.33 |
| Molecular Formula: | C17 H20 Br N3 O3 S |
| Smiles: | Cc1c(c(C)n(Cc2cc(ccc2OC)C2NC(CS2)C(O)=O)n1)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.5138 |
| logD: | -1.9486 |
| logSw: | -2.284 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.525 |
| InChI Key: | KMIJZKKRDNQFTK-UHFFFAOYSA-N |