4-[(1,3-benzoxazol-2-yl)methyl]-N-(4-bromophenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-[(1,3-benzoxazol-2-yl)methyl]-N-(4-bromophenyl)piperazine-1-carboxamide
4-[(1,3-benzoxazol-2-yl)methyl]-N-(4-bromophenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | F874-0457 |
| Compound Name: | 4-[(1,3-benzoxazol-2-yl)methyl]-N-(4-bromophenyl)piperazine-1-carboxamide |
| Molecular Weight: | 415.29 |
| Molecular Formula: | C19 H19 Br N4 O2 |
| Smiles: | [H]c1ccc2c(c1)oc(CN1CCN(CC1)C(Nc1ccc(cc1)[Br])=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.8051 |
| logD: | 3.7958 |
| logSw: | -4.0389 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.995 |
| InChI Key: | ZIHXQPRVCQEYNL-UHFFFAOYSA-N |