3-{[2-(4-chlorophenyl)ethyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
3-{[2-(4-chlorophenyl)ethyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
3-{[2-(4-chlorophenyl)ethyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
| Compound ID: | E013-2887 |
| Compound Name: | 3-{[2-(4-chlorophenyl)ethyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione |
| Molecular Weight: | 402.94 |
| Molecular Formula: | C21 H23 Cl N2 O2 S |
| Smiles: | CC(C)c1ccc(cc1)C1=C(C)C(NCCc2ccc(cc2)[Cl])=NS1(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9974 |
| logD: | 4.9974 |
| logSw: | -5.3052 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.008 |
| InChI Key: | MHJNZRWRBVLNOL-UHFFFAOYSA-N |