N-(4-bromophenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
N-(4-bromophenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-3492 |
| Compound Name: | N-(4-bromophenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide |
| Molecular Weight: | 335.2 |
| Molecular Formula: | C15 H15 Br N2 O2 |
| Smiles: | C1CCc2c(C(Nc3ccc(cc3)[Br])=O)noc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.1657 |
| logD: | 4.1642 |
| logSw: | -4.233 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.061 |
| InChI Key: | KNYFWTPAKHLLEX-UHFFFAOYSA-N |