5-{[(4-tert-butylphenyl)methyl]sulfanyl}-3,6-diphenyl-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-diphenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-{[(4-tert-butylphenyl)methyl]sulfanyl}-3,6-diphenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-3653 |
| Compound Name: | 5-{[(4-tert-butylphenyl)methyl]sulfanyl}-3,6-diphenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 515.72 |
| Molecular Formula: | C28 H25 N3 O S3 |
| Smiles: | CC(C)(C)c1ccc(CSC2=NC3=C(C(N2c2ccccc2)=O)SC(N3c2ccccc2)=S)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.7835 |
| logD: | 6.7835 |
| logSw: | -5.7599 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 26.9545 |
| InChI Key: | LIXYIQABVSIKGC-UHFFFAOYSA-N |