N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-[(2-methylpropyl)amino]-2-oxoethyl}-4-methylbenzamide
Chemical Structure Depiction of
N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-[(2-methylpropyl)amino]-2-oxoethyl}-4-methylbenzamide
N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-[(2-methylpropyl)amino]-2-oxoethyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | V020-1428 |
| Compound Name: | N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-[(2-methylpropyl)amino]-2-oxoethyl}-4-methylbenzamide |
| Molecular Weight: | 418.6 |
| Molecular Formula: | C22 H34 N4 O2 S |
| Smiles: | CCNC(N1CCC(CC1)C(C(NCC(C)C)=O)NC(c1ccc(C)cc1)=O)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.287 |
| logD: | 3.287 |
| logSw: | -3.3698 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 60.806 |
| InChI Key: | HHMWXVTWICCNBT-IBGZPJMESA-N |