4-[1-(4-methoxybenzene-1-sulfonyl)azetidin-3-yl]-3-(oxan-4-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
4-[1-(4-methoxybenzene-1-sulfonyl)azetidin-3-yl]-3-(oxan-4-yl)-4H-1,2,4-triazole
4-[1-(4-methoxybenzene-1-sulfonyl)azetidin-3-yl]-3-(oxan-4-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | S937-0400 |
| Compound Name: | 4-[1-(4-methoxybenzene-1-sulfonyl)azetidin-3-yl]-3-(oxan-4-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C17 H22 N4 O4 S |
| Smiles: | COc1ccc(cc1)S(N1CC(C1)n1cnnc1C1CCOCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2239 |
| logD: | 1.2237 |
| logSw: | -2.3162 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.976 |
| InChI Key: | MPSNHDWBFSFTQV-UHFFFAOYSA-N |