2-(3-{[(1,3-benzoxazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)-1,3-thiazolidine-4-carboxylic acid
Chemical Structure Depiction of
2-(3-{[(1,3-benzoxazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)-1,3-thiazolidine-4-carboxylic acid
2-(3-{[(1,3-benzoxazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)-1,3-thiazolidine-4-carboxylic acid
Compound characteristics
| Compound ID: | 8012-4489 |
| Compound Name: | 2-(3-{[(1,3-benzoxazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)-1,3-thiazolidine-4-carboxylic acid |
| Molecular Weight: | 402.49 |
| Molecular Formula: | C19 H18 N2 O4 S2 |
| Smiles: | COc1ccc(cc1CSc1nc2ccccc2o1)C1NC(CS1)C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.967 |
| logD: | -0.4954 |
| logSw: | -3.2315 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.635 |
| InChI Key: | HHJMIFAGHMJTAL-UHFFFAOYSA-N |