N-{2-[(butan-2-yl)amino]-1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-oxoethyl}-3-methoxybenzamide
Chemical Structure Depiction of
N-{2-[(butan-2-yl)amino]-1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-oxoethyl}-3-methoxybenzamide
N-{2-[(butan-2-yl)amino]-1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-oxoethyl}-3-methoxybenzamide
Compound characteristics
| Compound ID: | V009-4259 |
| Compound Name: | N-{2-[(butan-2-yl)amino]-1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-oxoethyl}-3-methoxybenzamide |
| Molecular Weight: | 434.6 |
| Molecular Formula: | C22 H34 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCC(C)NC(C(C1CCN(CC1)C(NCC)=S)NC(c1cccc(c1)OC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0369 |
| logD: | 3.0369 |
| logSw: | -3.4384 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 67.792 |
| InChI Key: | VSRRQLGURUJRSM-UHFFFAOYSA-N |