N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-[(2-methylpropyl)amino]-2-oxoethyl}-4-methoxybenzamide
Chemical Structure Depiction of
N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-[(2-methylpropyl)amino]-2-oxoethyl}-4-methoxybenzamide
N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-[(2-methylpropyl)amino]-2-oxoethyl}-4-methoxybenzamide
Compound characteristics
| Compound ID: | V031-0417 |
| Compound Name: | N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-[(2-methylpropyl)amino]-2-oxoethyl}-4-methoxybenzamide |
| Molecular Weight: | 434.6 |
| Molecular Formula: | C22 H34 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCNC(N1CCC(CC1)C(C(NCC(C)C)=O)NC(c1ccc(cc1)OC)=O)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.846 |
| logD: | 2.846 |
| logSw: | -3.2948 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 68.35 |
| InChI Key: | IPZCQDDKGVFMMG-IBGZPJMESA-N |