methyl [4-(4-chlorophenyl)-3-oxo-5-(piperidin-1-yl)thiophen-2(3H)-ylidene]acetate
Chemical Structure Depiction of
methyl [4-(4-chlorophenyl)-3-oxo-5-(piperidin-1-yl)thiophen-2(3H)-ylidene]acetate
methyl [4-(4-chlorophenyl)-3-oxo-5-(piperidin-1-yl)thiophen-2(3H)-ylidene]acetate
Compound characteristics
| Compound ID: | Y010-1953 |
| Compound Name: | methyl [4-(4-chlorophenyl)-3-oxo-5-(piperidin-1-yl)thiophen-2(3H)-ylidene]acetate |
| Molecular Weight: | 363.86 |
| Molecular Formula: | C18 H18 Cl N O3 S |
| Smiles: | COC(/C=C1/C(C(=C(N2CCCCC2)S1)c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.454 |
| logD: | 4.454 |
| logSw: | -4.6025 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.886 |
| InChI Key: | OCHAAUXCMUGEOG-UHFFFAOYSA-N |