N,3-dimethyl-N-{2-[5-(4-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}phenyl)-1,2,4-oxadiazol-3-yl]ethyl}benzamide
Chemical Structure Depiction of
N,3-dimethyl-N-{2-[5-(4-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}phenyl)-1,2,4-oxadiazol-3-yl]ethyl}benzamide
N,3-dimethyl-N-{2-[5-(4-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}phenyl)-1,2,4-oxadiazol-3-yl]ethyl}benzamide
Compound characteristics
| Compound ID: | L084-0563 |
| Compound Name: | N,3-dimethyl-N-{2-[5-(4-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}phenyl)-1,2,4-oxadiazol-3-yl]ethyl}benzamide |
| Molecular Weight: | 490.61 |
| Molecular Formula: | C27 H34 N6 O3 |
| Smiles: | Cc1cccc(c1)C(N(C)CCc1nc(c2ccc(cc2)C(NCCN2CCN(C)CC2)=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7338 |
| logD: | 1.0663 |
| logSw: | -2.2118 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.749 |
| InChI Key: | KJCCMLJMBDONBO-UHFFFAOYSA-N |