methyl 2-(2-{[5-(3-bromophenyl)-1,3-oxazol-2-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
methyl 2-(2-{[5-(3-bromophenyl)-1,3-oxazol-2-yl]sulfanyl}acetamido)benzoate
methyl 2-(2-{[5-(3-bromophenyl)-1,3-oxazol-2-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | F465-0917 |
| Compound Name: | methyl 2-(2-{[5-(3-bromophenyl)-1,3-oxazol-2-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 447.31 |
| Molecular Formula: | C19 H15 Br N2 O4 S |
| Smiles: | COC(c1ccccc1NC(CSc1ncc(c2cccc(c2)[Br])o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4566 |
| logD: | 4.4436 |
| logSw: | -4.2756 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.897 |
| InChI Key: | ALTIAROUHDWYNC-UHFFFAOYSA-N |