4-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-chlorobenzoate
Chemical Structure Depiction of
4-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-chlorobenzoate
4-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-chlorobenzoate
Compound characteristics
Compound ID: | 3584-0665 |
Compound Name: | 4-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-chlorobenzoate |
Molecular Weight: | 433.93 |
Molecular Formula: | C20 H16 Cl N O4 S2 |
Smiles: | CCN1C(/C(=C\c2ccc(c(c2)OC)OC(c2ccc(cc2)[Cl])=O)SC1=S)=O |
Stereo: | ACHIRAL |
logP: | 4.7626 |
logD: | 4.7626 |
logSw: | -5.2128 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 44.534 |
InChI Key: | AKRNLNPANTVPHH-UHFFFAOYSA-N |