3-{[4-(3-chloro-2-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2-benzoxazole
Chemical Structure Depiction of
3-{[4-(3-chloro-2-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2-benzoxazole
3-{[4-(3-chloro-2-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2-benzoxazole
Compound characteristics
| Compound ID: | L269-0969 |
| Compound Name: | 3-{[4-(3-chloro-2-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2-benzoxazole |
| Molecular Weight: | 405.9 |
| Molecular Formula: | C19 H20 Cl N3 O3 S |
| Smiles: | Cc1c(cccc1[Cl])S(N1CCN(CC1)Cc1c2ccccc2on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6225 |
| logD: | 3.622 |
| logSw: | -3.7588 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.184 |
| InChI Key: | SEZXIMXDHUOIIW-UHFFFAOYSA-N |