N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | G637-1236 |
| Compound Name: | N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide |
| Molecular Weight: | 595.74 |
| Molecular Formula: | C31 H38 F N5 O4 S |
| Smiles: | CCN1CCN(CC1)Cc1ccc(cc1)NC(C1CCN(CC1)S(c1c(C)noc1/C=C/c1ccccc1F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2035 |
| logD: | 2.2718 |
| logSw: | -3.2933 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.826 |
| InChI Key: | WJRWEKPTBCDJAF-UHFFFAOYSA-N |