N-[(4-methylphenyl)methyl]-2-{[3-(2-methylphenyl)-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-{[3-(2-methylphenyl)-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
N-[(4-methylphenyl)methyl]-2-{[3-(2-methylphenyl)-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | K286-4208 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-{[3-(2-methylphenyl)-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide |
| Molecular Weight: | 544.72 |
| Molecular Formula: | C28 H24 N4 O2 S3 |
| Smiles: | Cc1ccc(CNC(CSC2=NC3=C(C(N2c2ccccc2)=O)SC(N3c2ccccc2C)=S)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3189 |
| logD: | 5.3189 |
| logSw: | -5.2991 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.125 |
| InChI Key: | GYZLLTPNDPMVEW-UHFFFAOYSA-N |