5-(butylsulfanyl)-3-(3,4-dimethylphenyl)-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-(butylsulfanyl)-3-(3,4-dimethylphenyl)-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-(butylsulfanyl)-3-(3,4-dimethylphenyl)-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-4176 |
| Compound Name: | 5-(butylsulfanyl)-3-(3,4-dimethylphenyl)-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 453.65 |
| Molecular Formula: | C23 H23 N3 O S3 |
| Smiles: | CCCCSC1=NC2=C(C(N1c1ccccc1)=O)SC(N2c1ccc(C)c(C)c1)=S |
| Stereo: | ACHIRAL |
| logP: | 6.5613 |
| logD: | 6.5613 |
| logSw: | -5.4855 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 27.226 |
| InChI Key: | JGGFYWCLDCXJPM-UHFFFAOYSA-N |