4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)oxy]-3-methoxybenzaldehyde
Chemical Structure Depiction of
4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)oxy]-3-methoxybenzaldehyde
4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)oxy]-3-methoxybenzaldehyde
Compound characteristics
| Compound ID: | 4489-8636 |
| Compound Name: | 4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)oxy]-3-methoxybenzaldehyde |
| Molecular Weight: | 317.32 |
| Molecular Formula: | C15 H11 N O5 S |
| Smiles: | COc1cc(C=O)ccc1OC1c2ccccc2S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7574 |
| logD: | 1.7574 |
| logSw: | -2.5563 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.012 |
| InChI Key: | JZCRGAXBJPNVEN-UHFFFAOYSA-N |