3,4,5-trimethoxy-2-({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamido}methyl)benzoic acid
Chemical Structure Depiction of
3,4,5-trimethoxy-2-({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamido}methyl)benzoic acid
3,4,5-trimethoxy-2-({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamido}methyl)benzoic acid
Compound characteristics
| Compound ID: | 5535-0697 |
| Compound Name: | 3,4,5-trimethoxy-2-({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamido}methyl)benzoic acid |
| Molecular Weight: | 397.41 |
| Molecular Formula: | C15 H19 N5 O6 S |
| Smiles: | Cn1c(nnn1)SCC(NCc1c(cc(c(c1OC)OC)OC)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0553 |
| logD: | -0.8637 |
| logSw: | -2.1309 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 116.254 |
| InChI Key: | SEEGFFQRXSQLOZ-UHFFFAOYSA-N |