N-(3-cyanophenyl)-N'-[1-(4-methyl-1,1-dioxo-5-phenyl-1H-1lambda~6~,2-thiazol-3-yl)piperidin-4-yl]urea
Chemical Structure Depiction of
N-(3-cyanophenyl)-N'-[1-(4-methyl-1,1-dioxo-5-phenyl-1H-1lambda~6~,2-thiazol-3-yl)piperidin-4-yl]urea
N-(3-cyanophenyl)-N'-[1-(4-methyl-1,1-dioxo-5-phenyl-1H-1lambda~6~,2-thiazol-3-yl)piperidin-4-yl]urea
Compound characteristics
| Compound ID: | T377-0009 |
| Compound Name: | N-(3-cyanophenyl)-N'-[1-(4-methyl-1,1-dioxo-5-phenyl-1H-1lambda~6~,2-thiazol-3-yl)piperidin-4-yl]urea |
| Molecular Weight: | 449.53 |
| Molecular Formula: | C23 H23 N5 O3 S |
| Smiles: | CC1=C(c2ccccc2)S(N=C1N1CCC(CC1)NC(Nc1cccc(C#N)c1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1856 |
| logD: | 3.1856 |
| logSw: | -3.5999 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.345 |
| InChI Key: | XJGUXTORHITHKH-UHFFFAOYSA-N |