methyl 3-{2-[(5-bromofuran-2-carbonyl)amino]-3-(furan-2-yl)prop-2-enamido}benzoate
Chemical Structure Depiction of
methyl 3-{2-[(5-bromofuran-2-carbonyl)amino]-3-(furan-2-yl)prop-2-enamido}benzoate
methyl 3-{2-[(5-bromofuran-2-carbonyl)amino]-3-(furan-2-yl)prop-2-enamido}benzoate
Compound characteristics
| Compound ID: | 3379-2319 |
| Compound Name: | methyl 3-{2-[(5-bromofuran-2-carbonyl)amino]-3-(furan-2-yl)prop-2-enamido}benzoate |
| Molecular Weight: | 459.25 |
| Molecular Formula: | C20 H15 Br N2 O6 |
| Smiles: | COC(c1cccc(c1)NC(/C(=C\c1ccco1)NC(c1ccc(o1)[Br])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9329 |
| logD: | 3.6631 |
| logSw: | -4.1396 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.103 |
| InChI Key: | YOPKRJZHZPGKIB-UHFFFAOYSA-N |