6-chloro-2-{[4-(2,5-dimethoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
Chemical Structure Depiction of
6-chloro-2-{[4-(2,5-dimethoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
6-chloro-2-{[4-(2,5-dimethoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
Compound characteristics
| Compound ID: | F874-0293 |
| Compound Name: | 6-chloro-2-{[4-(2,5-dimethoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole |
| Molecular Weight: | 451.93 |
| Molecular Formula: | C20 H22 Cl N3 O5 S |
| Smiles: | COc1ccc(c(c1)S(N1CCN(CC1)Cc1nc2ccc(cc2o1)[Cl])(=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.3034 |
| logD: | 3.3033 |
| logSw: | -3.6809 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.411 |
| InChI Key: | HHZZYTQJAMCHQU-UHFFFAOYSA-N |