methyl 2-{[4-(3-phenylprop-2-en-1-yl)piperazine-1-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[4-(3-phenylprop-2-en-1-yl)piperazine-1-carbonyl]amino}benzoate
methyl 2-{[4-(3-phenylprop-2-en-1-yl)piperazine-1-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | Y205-2450 |
| Compound Name: | methyl 2-{[4-(3-phenylprop-2-en-1-yl)piperazine-1-carbonyl]amino}benzoate |
| Molecular Weight: | 379.46 |
| Molecular Formula: | C22 H25 N3 O3 |
| Smiles: | COC(c1ccccc1NC(N1CCN(CC1)C/C=C/c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.697 |
| logD: | 3.6539 |
| logSw: | -3.9971 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.702 |
| InChI Key: | HYKPORUPQAPRPZ-UHFFFAOYSA-N |