3-{[2-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)-2-(2-hydroxyethyl)hydrazinylidene]methyl}-4-hydroxybenzoic acid
Chemical Structure Depiction of
3-{[2-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)-2-(2-hydroxyethyl)hydrazinylidene]methyl}-4-hydroxybenzoic acid
3-{[2-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)-2-(2-hydroxyethyl)hydrazinylidene]methyl}-4-hydroxybenzoic acid
Compound characteristics
| Compound ID: | 5251-2224 |
| Compound Name: | 3-{[2-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)-2-(2-hydroxyethyl)hydrazinylidene]methyl}-4-hydroxybenzoic acid |
| Molecular Weight: | 389.38 |
| Molecular Formula: | C17 H15 N3 O6 S |
| Smiles: | C(CO)N(C1c2ccccc2S(N=1)(=O)=O)/N=C/c1cc(ccc1O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4168 |
| logD: | -1.085 |
| logSw: | -2.3412 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 112.785 |
| InChI Key: | XAIDAMLDBHWWKN-UHFFFAOYSA-N |