3-[2-(diethylamino)ethyl]-5-{[(2-methylphenyl)methyl]sulfanyl}-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
3-[2-(diethylamino)ethyl]-5-{[(2-methylphenyl)methyl]sulfanyl}-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-[2-(diethylamino)ethyl]-5-{[(2-methylphenyl)methyl]sulfanyl}-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-3494 |
| Compound Name: | 3-[2-(diethylamino)ethyl]-5-{[(2-methylphenyl)methyl]sulfanyl}-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 496.72 |
| Molecular Formula: | C25 H28 N4 O S3 |
| Smiles: | CCN(CC)CCN1C2=C(C(N(C(=N2)SCc2ccccc2C)c2ccccc2)=O)SC1=S |
| Stereo: | ACHIRAL |
| logP: | 5.7776 |
| logD: | 3.9034 |
| logSw: | -5.4324 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 31.2271 |
| InChI Key: | MPXWIYVPUNNTFB-UHFFFAOYSA-N |