propan-2-yl 4-[2-hydroxy-4-(4-methoxyphenyl)-4-oxobut-2-enamido]benzoate
Chemical Structure Depiction of
propan-2-yl 4-[2-hydroxy-4-(4-methoxyphenyl)-4-oxobut-2-enamido]benzoate
propan-2-yl 4-[2-hydroxy-4-(4-methoxyphenyl)-4-oxobut-2-enamido]benzoate
Compound characteristics
| Compound ID: | C301-0206 |
| Compound Name: | propan-2-yl 4-[2-hydroxy-4-(4-methoxyphenyl)-4-oxobut-2-enamido]benzoate |
| Molecular Weight: | 383.4 |
| Molecular Formula: | C21 H21 N O6 |
| Smiles: | CC(C)OC(c1ccc(cc1)NC(/C(=C/C(c1ccc(cc1)OC)=O)O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2757 |
| logD: | 3.243 |
| logSw: | -3.5689 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.114 |
| InChI Key: | NTZMAKWLTQLYNR-UHFFFAOYSA-N |