4-[(4-butoxyphenyl)methyl]-N-(2-methoxy-4-nitrophenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-[(4-butoxyphenyl)methyl]-N-(2-methoxy-4-nitrophenyl)piperazine-1-carboxamide
4-[(4-butoxyphenyl)methyl]-N-(2-methoxy-4-nitrophenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y206-5828 |
| Compound Name: | 4-[(4-butoxyphenyl)methyl]-N-(2-methoxy-4-nitrophenyl)piperazine-1-carboxamide |
| Molecular Weight: | 442.51 |
| Molecular Formula: | C23 H30 N4 O5 |
| Smiles: | CCCCOc1ccc(CN2CCN(CC2)C(Nc2ccc(cc2OC)[N+]([O-])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4224 |
| logD: | 4.2424 |
| logSw: | -4.1207 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.98 |
| InChI Key: | YXQQSAZFYQGMHF-UHFFFAOYSA-N |