2-[1-(3,5-dimethylpiperidin-1-yl)-1-oxopropan-2-yl]-1,2-benzothiazol-3(2H)-one
Chemical Structure Depiction of
2-[1-(3,5-dimethylpiperidin-1-yl)-1-oxopropan-2-yl]-1,2-benzothiazol-3(2H)-one
2-[1-(3,5-dimethylpiperidin-1-yl)-1-oxopropan-2-yl]-1,2-benzothiazol-3(2H)-one
Compound characteristics
| Compound ID: | E022-0648 |
| Compound Name: | 2-[1-(3,5-dimethylpiperidin-1-yl)-1-oxopropan-2-yl]-1,2-benzothiazol-3(2H)-one |
| Molecular Weight: | 318.44 |
| Molecular Formula: | C17 H22 N2 O2 S |
| Smiles: | CC1CC(C)CN(C1)C(C(C)N1C(c2ccccc2S1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0901 |
| logD: | 3.0901 |
| logSw: | -3.4567 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.315 |
| InChI Key: | IHGWTBVMZNOSTI-UHFFFAOYSA-N |