4-methyl-5-[4-(propan-2-yl)phenyl]-3-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
4-methyl-5-[4-(propan-2-yl)phenyl]-3-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}-1H-1lambda~6~,2-thiazole-1,1-dione
4-methyl-5-[4-(propan-2-yl)phenyl]-3-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
| Compound ID: | E013-3152 |
| Compound Name: | 4-methyl-5-[4-(propan-2-yl)phenyl]-3-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}-1H-1lambda~6~,2-thiazole-1,1-dione |
| Molecular Weight: | 513.66 |
| Molecular Formula: | C27 H35 N3 O5 S |
| Smiles: | CC(C)c1ccc(cc1)C1=C(C)C(=NS1(=O)=O)N1CCN(CC1)Cc1ccc(c(c1OC)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.5433 |
| logD: | 4.0015 |
| logSw: | -4.265 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.735 |
| InChI Key: | LPRBVANYSKZBNM-UHFFFAOYSA-N |