2-{3-[(3-iodo-1-methyl-1H-pyrazole-5-carbonyl)oxy]phenyl}-1,3-thiazolidine-4-carboxylic acid
Chemical Structure Depiction of
2-{3-[(3-iodo-1-methyl-1H-pyrazole-5-carbonyl)oxy]phenyl}-1,3-thiazolidine-4-carboxylic acid
2-{3-[(3-iodo-1-methyl-1H-pyrazole-5-carbonyl)oxy]phenyl}-1,3-thiazolidine-4-carboxylic acid
Compound characteristics
| Compound ID: | 8011-9992 |
| Compound Name: | 2-{3-[(3-iodo-1-methyl-1H-pyrazole-5-carbonyl)oxy]phenyl}-1,3-thiazolidine-4-carboxylic acid |
| Molecular Weight: | 459.26 |
| Molecular Formula: | C15 H14 I N3 O4 S |
| Smiles: | Cn1c(cc(n1)I)C(=O)Oc1cccc(c1)C1NC(CS1)C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.1226 |
| logD: | -2.3398 |
| logSw: | -2.2985 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.974 |
| InChI Key: | YJGUVPVWDQFWNH-UHFFFAOYSA-N |