methyl 2-(3-{4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl}-2-cyanoprop-2-enamido)benzoate
Chemical Structure Depiction of
methyl 2-(3-{4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl}-2-cyanoprop-2-enamido)benzoate
methyl 2-(3-{4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl}-2-cyanoprop-2-enamido)benzoate
Compound characteristics
| Compound ID: | 8013-9643 |
| Compound Name: | methyl 2-(3-{4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl}-2-cyanoprop-2-enamido)benzoate |
| Molecular Weight: | 476.92 |
| Molecular Formula: | C26 H21 Cl N2 O5 |
| Smiles: | COC(c1ccccc1NC(C(=C\c1ccc(c(c1)OC)OCc1ccccc1[Cl])\C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0851 |
| logD: | 3.6972 |
| logSw: | -5.2957 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.807 |
| InChI Key: | VRKYDXRHDHDXBA-UHFFFAOYSA-N |