4-cyano-N-{1-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidin-4-yl}benzamide
Chemical Structure Depiction of
4-cyano-N-{1-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidin-4-yl}benzamide
4-cyano-N-{1-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidin-4-yl}benzamide
Compound characteristics
| Compound ID: | P532-0229 |
| Compound Name: | 4-cyano-N-{1-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidin-4-yl}benzamide |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C24 H24 N4 O3 S |
| Smiles: | CC1=C(c2ccc(C)cc2)S(N=C1N1CCC(CC1)NC(c1ccc(C#N)cc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2433 |
| logD: | 3.2433 |
| logSw: | -3.4859 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.133 |
| InChI Key: | RQRKXLPTQIQJMZ-UHFFFAOYSA-N |