3-{[4-(5-fluoro-2-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2-benzoxazole
Chemical Structure Depiction of
3-{[4-(5-fluoro-2-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2-benzoxazole
3-{[4-(5-fluoro-2-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2-benzoxazole
Compound characteristics
| Compound ID: | L269-0961 |
| Compound Name: | 3-{[4-(5-fluoro-2-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2-benzoxazole |
| Molecular Weight: | 389.45 |
| Molecular Formula: | C19 H20 F N3 O3 S |
| Smiles: | Cc1ccc(cc1S(N1CCN(CC1)Cc1c2ccccc2on1)(=O)=O)F |
| Stereo: | ACHIRAL |
| logP: | 3.1716 |
| logD: | 3.171 |
| logSw: | -3.1888 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.184 |
| InChI Key: | YOQQLDUOJHOTFM-UHFFFAOYSA-N |