(4-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)(1H-pyrrol-2-yl)methanone
Chemical Structure Depiction of
(4-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)(1H-pyrrol-2-yl)methanone
(4-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)(1H-pyrrol-2-yl)methanone
Compound characteristics
| Compound ID: | S454-0400 |
| Compound Name: | (4-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)(1H-pyrrol-2-yl)methanone |
| Molecular Weight: | 355.4 |
| Molecular Formula: | C17 H21 N7 O2 |
| Smiles: | CC(C)c1nc(c2cn(C3CCN(CC3)C(c3ccc[nH]3)=O)nn2)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.2003 |
| logD: | 2.2003 |
| logSw: | -2.3804 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.636 |
| InChI Key: | IIGCJKVTLHBDPF-UHFFFAOYSA-N |