5-{[(4-tert-butylphenyl)methyl]sulfanyl}-3,6-bis(2,6-dimethylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-{[(4-tert-butylphenyl)methyl]sulfanyl}-3,6-bis(2,6-dimethylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-{[(4-tert-butylphenyl)methyl]sulfanyl}-3,6-bis(2,6-dimethylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-0028 |
| Compound Name: | 5-{[(4-tert-butylphenyl)methyl]sulfanyl}-3,6-bis(2,6-dimethylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 571.83 |
| Molecular Formula: | C32 H33 N3 O S3 |
| Smiles: | Cc1cccc(C)c1N1C(=NC2=C(C1=O)SC(N2c1c(C)cccc1C)=S)SCc1ccc(cc1)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 8.5993 |
| logD: | 8.5993 |
| logSw: | -5.7669 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 25.7508 |
| InChI Key: | RHUWBTILNKVHQU-UHFFFAOYSA-N |