ethyl 4-{[4-(3-phenylprop-2-en-1-yl)piperazine-1-carbothioyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[4-(3-phenylprop-2-en-1-yl)piperazine-1-carbothioyl]amino}benzoate
ethyl 4-{[4-(3-phenylprop-2-en-1-yl)piperazine-1-carbothioyl]amino}benzoate
Compound characteristics
| Compound ID: | 5743-0331 |
| Compound Name: | ethyl 4-{[4-(3-phenylprop-2-en-1-yl)piperazine-1-carbothioyl]amino}benzoate |
| Molecular Weight: | 409.55 |
| Molecular Formula: | C23 H27 N3 O2 S |
| Smiles: | CCOC(c1ccc(cc1)NC(N1CCN(CC1)C/C=C/c1ccccc1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9416 |
| logD: | 4.9056 |
| logSw: | -4.441 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.409 |
| InChI Key: | YGGOOACURLFNCK-UHFFFAOYSA-N |