methyl N-({1-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidin-4-yl}carbamoyl)alaninate
Chemical Structure Depiction of
methyl N-({1-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidin-4-yl}carbamoyl)alaninate
methyl N-({1-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidin-4-yl}carbamoyl)alaninate
Compound characteristics
| Compound ID: | T377-0005 |
| Compound Name: | methyl N-({1-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidin-4-yl}carbamoyl)alaninate |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C21 H28 N4 O5 S |
| Smiles: | CC(C(=O)OC)NC(NC1CCN(CC1)C1C(C)=C(c2ccc(C)cc2)S(N=1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.215 |
| logD: | 2.215 |
| logSw: | -2.6361 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.219 |
| InChI Key: | DCDWCUKYEQYFCC-HNNXBMFYSA-N |