3-(1,3-benzothiazol-2-yl)-1-{3-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]azetidin-1-yl}propan-1-one
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-1-{3-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]azetidin-1-yl}propan-1-one
3-(1,3-benzothiazol-2-yl)-1-{3-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]azetidin-1-yl}propan-1-one
Compound characteristics
| Compound ID: | S727-0126 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-1-{3-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]azetidin-1-yl}propan-1-one |
| Molecular Weight: | 343.41 |
| Molecular Formula: | C16 H17 N5 O2 S |
| Smiles: | C(Cc1nc2ccccc2s1)C(N1CC(C1)n1cc(CO)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7721 |
| logD: | 0.772 |
| logSw: | -1.4412 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.39 |
| InChI Key: | UPRFPMYFPFAQSG-UHFFFAOYSA-N |