4-({2-[2-(1H-pyrrol-1-yl)-1,3-thiazol-4-yl]acetamido}methyl)benzoic acid
Chemical Structure Depiction of
4-({2-[2-(1H-pyrrol-1-yl)-1,3-thiazol-4-yl]acetamido}methyl)benzoic acid
4-({2-[2-(1H-pyrrol-1-yl)-1,3-thiazol-4-yl]acetamido}methyl)benzoic acid
Compound characteristics
| Compound ID: | Y044-4995 |
| Compound Name: | 4-({2-[2-(1H-pyrrol-1-yl)-1,3-thiazol-4-yl]acetamido}methyl)benzoic acid |
| Molecular Weight: | 341.39 |
| Molecular Formula: | C17 H15 N3 O3 S |
| Smiles: | C(C(NCc1ccc(cc1)C(O)=O)=O)c1csc(n1)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1926 |
| logD: | 0.2211 |
| logSw: | -3.2784 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.148 |
| InChI Key: | UUZDEARBICLKOK-UHFFFAOYSA-N |