methyl 3-{2-[(5-bromofuran-2-carbonyl)amino]-3-(4-methoxyphenyl)prop-2-enamido}benzoate
Chemical Structure Depiction of
methyl 3-{2-[(5-bromofuran-2-carbonyl)amino]-3-(4-methoxyphenyl)prop-2-enamido}benzoate
methyl 3-{2-[(5-bromofuran-2-carbonyl)amino]-3-(4-methoxyphenyl)prop-2-enamido}benzoate
Compound characteristics
Compound ID: | 3379-2310 |
Compound Name: | methyl 3-{2-[(5-bromofuran-2-carbonyl)amino]-3-(4-methoxyphenyl)prop-2-enamido}benzoate |
Molecular Weight: | 499.32 |
Molecular Formula: | C23 H19 Br N2 O6 |
Smiles: | COC(c1cccc(c1)NC(/C(=C\c1ccc(cc1)OC)NC(c1ccc(o1)[Br])=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.6663 |
logD: | 3.7494 |
logSw: | -4.5838 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 82.898 |
InChI Key: | ABUDAZLGATVUHE-UHFFFAOYSA-N |