N-(3-bromophenyl)-4-[(4-butoxyphenyl)methyl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(3-bromophenyl)-4-[(4-butoxyphenyl)methyl]piperazine-1-carboxamide
N-(3-bromophenyl)-4-[(4-butoxyphenyl)methyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y206-5971 |
| Compound Name: | N-(3-bromophenyl)-4-[(4-butoxyphenyl)methyl]piperazine-1-carboxamide |
| Molecular Weight: | 446.39 |
| Molecular Formula: | C22 H28 Br N3 O2 |
| Smiles: | CCCCOc1ccc(CN2CCN(CC2)C(Nc2cccc(c2)[Br])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0189 |
| logD: | 4.8414 |
| logSw: | -4.4947 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.666 |
| InChI Key: | NXCIRGFNHMPUNX-UHFFFAOYSA-N |