1-{3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl}-4-(4-nitrophenyl)piperazine
Chemical Structure Depiction of
1-{3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl}-4-(4-nitrophenyl)piperazine
1-{3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl}-4-(4-nitrophenyl)piperazine
Compound characteristics
| Compound ID: | V025-9569 |
| Compound Name: | 1-{3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl}-4-(4-nitrophenyl)piperazine |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C20 H21 N5 O3 S |
| Salt: | not_available |
| Smiles: | COc1cccc(Cc2nc(N3CCN(CC3)c3ccc(cc3)[N+]([O-])=O)sn2)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.6356 |
| logD: | 4.6356 |
| logSw: | -4.6254 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.229 |
| InChI Key: | NUJCJOYZUMYREP-UHFFFAOYSA-N |