methyl 2-{[3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]amino}benzoate
methyl 2-{[3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | 7610-2167 |
| Compound Name: | methyl 2-{[3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]amino}benzoate |
| Molecular Weight: | 403.23 |
| Molecular Formula: | C18 H15 Br N2 O4 |
| Smiles: | COC(c1ccccc1NC(C1CC(c2cccc(c2)[Br])=NO1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0403 |
| logD: | 3.9612 |
| logSw: | -4.2712 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.399 |
| InChI Key: | ISFKUZAQNCLQGH-MRXNPFEDSA-N |