3-{[4-(3,4-dimethoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2-benzoxazole
Chemical Structure Depiction of
3-{[4-(3,4-dimethoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2-benzoxazole
3-{[4-(3,4-dimethoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2-benzoxazole
Compound characteristics
| Compound ID: | L269-0936 |
| Compound Name: | 3-{[4-(3,4-dimethoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2-benzoxazole |
| Molecular Weight: | 417.48 |
| Molecular Formula: | C20 H23 N3 O5 S |
| Smiles: | COc1ccc(cc1OC)S(N1CCN(CC1)Cc1c2ccccc2on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3809 |
| logD: | 2.3803 |
| logSw: | -2.8409 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.445 |
| InChI Key: | RDKDMXGTFIJLEL-UHFFFAOYSA-N |