2-{[4-(2-chlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-6-methyl-1,3-benzoxazole
Chemical Structure Depiction of
2-{[4-(2-chlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-6-methyl-1,3-benzoxazole
2-{[4-(2-chlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-6-methyl-1,3-benzoxazole
Compound characteristics
| Compound ID: | F874-0398 |
| Compound Name: | 2-{[4-(2-chlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-6-methyl-1,3-benzoxazole |
| Molecular Weight: | 405.9 |
| Molecular Formula: | C19 H20 Cl N3 O3 S |
| Smiles: | Cc1ccc2c(c1)oc(CN1CCN(CC1)S(c1ccccc1[Cl])(=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.3287 |
| logD: | 3.3286 |
| logSw: | -3.4869 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.237 |
| InChI Key: | MTUBMPSKYJBRGM-UHFFFAOYSA-N |