N-{2-[(butan-2-yl)amino]-1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-oxoethyl}benzamide
Chemical Structure Depiction of
N-{2-[(butan-2-yl)amino]-1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-oxoethyl}benzamide
N-{2-[(butan-2-yl)amino]-1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-oxoethyl}benzamide
Compound characteristics
| Compound ID: | V008-1534 |
| Compound Name: | N-{2-[(butan-2-yl)amino]-1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-oxoethyl}benzamide |
| Molecular Weight: | 404.57 |
| Molecular Formula: | C21 H32 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCC(C)NC(C(C1CCN(CC1)C(NCC)=S)NC(c1ccccc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.8697 |
| logD: | 2.8697 |
| logSw: | -3.2989 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 60.248 |
| InChI Key: | GSUNXUMJUZYCMO-UHFFFAOYSA-N |