4-{2-benzamido-3-[3-(hydroxymethyl)anilino]-3-oxoprop-1-en-1-yl}-2-methoxyphenyl acetate
Chemical Structure Depiction of
4-{2-benzamido-3-[3-(hydroxymethyl)anilino]-3-oxoprop-1-en-1-yl}-2-methoxyphenyl acetate
4-{2-benzamido-3-[3-(hydroxymethyl)anilino]-3-oxoprop-1-en-1-yl}-2-methoxyphenyl acetate
Compound characteristics
| Compound ID: | 8005-5889 |
| Compound Name: | 4-{2-benzamido-3-[3-(hydroxymethyl)anilino]-3-oxoprop-1-en-1-yl}-2-methoxyphenyl acetate |
| Molecular Weight: | 460.49 |
| Molecular Formula: | C26 H24 N2 O6 |
| Smiles: | CC(=O)Oc1ccc(/C=C(/C(Nc2cccc(CO)c2)=O)NC(c2ccccc2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.6238 |
| logD: | 2.564 |
| logSw: | -3.2154 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.838 |
| InChI Key: | ZWQWUXJOSIEPAF-UHFFFAOYSA-N |