2-[(4-chlorophenyl)methyl]-4-methyl-1,3-thiazole-5-carboxylic acid
Chemical Structure Depiction of
2-[(4-chlorophenyl)methyl]-4-methyl-1,3-thiazole-5-carboxylic acid
2-[(4-chlorophenyl)methyl]-4-methyl-1,3-thiazole-5-carboxylic acid
Compound characteristics
| Compound ID: | Y507-0172 |
| Compound Name: | 2-[(4-chlorophenyl)methyl]-4-methyl-1,3-thiazole-5-carboxylic acid |
| Molecular Weight: | 267.73 |
| Molecular Formula: | C12 H10 Cl N O2 S |
| Smiles: | Cc1c(C(O)=O)sc(Cc2ccc(cc2)[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 3.1688 |
| logD: | -1.0206 |
| logSw: | -3.2708 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.453 |
| InChI Key: | WCRPOVQKXFFTAG-UHFFFAOYSA-N |