2-{4-[(1H-1,2,4-triazol-1-yl)methyl]anilino}-1,3-thiazole-4-carboxylic acid
Chemical Structure Depiction of
2-{4-[(1H-1,2,4-triazol-1-yl)methyl]anilino}-1,3-thiazole-4-carboxylic acid
2-{4-[(1H-1,2,4-triazol-1-yl)methyl]anilino}-1,3-thiazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y040-9078 |
| Compound Name: | 2-{4-[(1H-1,2,4-triazol-1-yl)methyl]anilino}-1,3-thiazole-4-carboxylic acid |
| Molecular Weight: | 301.32 |
| Molecular Formula: | C13 H11 N5 O2 S |
| Smiles: | C(c1ccc(cc1)Nc1nc(cs1)C(O)=O)n1cncn1 |
| Stereo: | ACHIRAL |
| logP: | 1.5113 |
| logD: | -2.0084 |
| logSw: | -2.0997 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.582 |
| InChI Key: | OZSLFMOWJYFHOP-UHFFFAOYSA-N |