3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
| Compound ID: | E013-3120 |
| Compound Name: | 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione |
| Molecular Weight: | 437.6 |
| Molecular Formula: | C25 H31 N3 O2 S |
| Smiles: | CC(C)c1ccc(cc1)C1=C(C)C(=NS1(=O)=O)N1CCN(CC1)c1cccc(C)c1C |
| Stereo: | ACHIRAL |
| logP: | 6.0381 |
| logD: | 6.0379 |
| logSw: | -5.6563 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.09 |
| InChI Key: | VLQDRGUZWNMGFR-UHFFFAOYSA-N |