5-{2-cyano-3-[2-(methoxycarbonyl)anilino]-3-oxoprop-1-en-1-yl}-2-methoxyphenyl naphthalene-1-carboxylate
Chemical Structure Depiction of
5-{2-cyano-3-[2-(methoxycarbonyl)anilino]-3-oxoprop-1-en-1-yl}-2-methoxyphenyl naphthalene-1-carboxylate
5-{2-cyano-3-[2-(methoxycarbonyl)anilino]-3-oxoprop-1-en-1-yl}-2-methoxyphenyl naphthalene-1-carboxylate
Compound characteristics
| Compound ID: | 8013-9660 |
| Compound Name: | 5-{2-cyano-3-[2-(methoxycarbonyl)anilino]-3-oxoprop-1-en-1-yl}-2-methoxyphenyl naphthalene-1-carboxylate |
| Molecular Weight: | 506.51 |
| Molecular Formula: | C30 H22 N2 O6 |
| Smiles: | COC(c1ccccc1NC(C(=C\c1ccc(c(c1)OC(c1cccc2ccccc12)=O)OC)\C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8009 |
| logD: | 4.4129 |
| logSw: | -6.7324 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.685 |
| InChI Key: | XUYGOTYYCLDIGO-UHFFFAOYSA-N |