methyl 2-{[5-(4-bromophenyl)-1,2-oxazole-3-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[5-(4-bromophenyl)-1,2-oxazole-3-carbonyl]amino}benzoate
methyl 2-{[5-(4-bromophenyl)-1,2-oxazole-3-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | C226-0515 |
| Compound Name: | methyl 2-{[5-(4-bromophenyl)-1,2-oxazole-3-carbonyl]amino}benzoate |
| Molecular Weight: | 401.21 |
| Molecular Formula: | C18 H13 Br N2 O4 |
| Smiles: | COC(c1ccccc1NC(c1cc(c2ccc(cc2)[Br])on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5885 |
| logD: | 4.5642 |
| logSw: | -4.4491 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.341 |
| InChI Key: | SZPQKVSTKFTUJK-UHFFFAOYSA-N |