3-ethyl-5-[(2-oxo-2-phenylethyl)sulfanyl]-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
3-ethyl-5-[(2-oxo-2-phenylethyl)sulfanyl]-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-ethyl-5-[(2-oxo-2-phenylethyl)sulfanyl]-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-3815 |
| Compound Name: | 3-ethyl-5-[(2-oxo-2-phenylethyl)sulfanyl]-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 439.58 |
| Molecular Formula: | C21 H17 N3 O2 S3 |
| Smiles: | CCN1C2=C(C(N(C(=N2)SCC(c2ccccc2)=O)c2ccccc2)=O)SC1=S |
| Stereo: | ACHIRAL |
| logP: | 3.9818 |
| logD: | 3.9818 |
| logSw: | -4.0491 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 40.809 |
| InChI Key: | YWXXYEBJCHDGBP-UHFFFAOYSA-N |