methyl 4-{2-[(5-bromofuran-2-carbonyl)amino]-3-phenylprop-2-enamido}benzoate
Chemical Structure Depiction of
methyl 4-{2-[(5-bromofuran-2-carbonyl)amino]-3-phenylprop-2-enamido}benzoate
methyl 4-{2-[(5-bromofuran-2-carbonyl)amino]-3-phenylprop-2-enamido}benzoate
Compound characteristics
| Compound ID: | 3379-2201 |
| Compound Name: | methyl 4-{2-[(5-bromofuran-2-carbonyl)amino]-3-phenylprop-2-enamido}benzoate |
| Molecular Weight: | 469.29 |
| Molecular Formula: | C22 H17 Br N2 O5 |
| Smiles: | COC(c1ccc(cc1)NC(/C(=C\c1ccccc1)NC(c1ccc(o1)[Br])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5076 |
| logD: | 3.5907 |
| logSw: | -4.4621 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.354 |
| InChI Key: | LICFTJHEDNLQJW-UHFFFAOYSA-N |