4-(1,3-benzothiazol-2-yl)-1-{3-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]azetidin-1-yl}butan-1-one
Chemical Structure Depiction of
4-(1,3-benzothiazol-2-yl)-1-{3-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]azetidin-1-yl}butan-1-one
4-(1,3-benzothiazol-2-yl)-1-{3-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]azetidin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | S727-2330 |
| Compound Name: | 4-(1,3-benzothiazol-2-yl)-1-{3-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]azetidin-1-yl}butan-1-one |
| Molecular Weight: | 357.43 |
| Molecular Formula: | C17 H19 N5 O2 S |
| Smiles: | C(CC(N1CC(C1)n1cc(CO)nn1)=O)Cc1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 1.097 |
| logD: | 1.097 |
| logSw: | -1.6729 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.39 |
| InChI Key: | OUDJFTOJCAKSHD-UHFFFAOYSA-N |