2-{[4-(3,4-dimethoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
Chemical Structure Depiction of
2-{[4-(3,4-dimethoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
2-{[4-(3,4-dimethoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
Compound characteristics
| Compound ID: | F874-0044 |
| Compound Name: | 2-{[4-(3,4-dimethoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole |
| Molecular Weight: | 417.48 |
| Molecular Formula: | C20 H23 N3 O5 S |
| Smiles: | [H]c1ccc2c(c1)nc(CN1CCN(CC1)S(c1ccc(c(c1)OC)OC)(=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 2.4886 |
| logD: | 2.4884 |
| logSw: | -2.8193 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.498 |
| InChI Key: | IKTOAGDYFDDRNG-UHFFFAOYSA-N |