2-{6-[(3-methylphenyl)methyl]-5,7-dioxo-6,7-dihydro[1,2]thiazolo[4,3-d]pyrimidin-4(5H)-yl}-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{6-[(3-methylphenyl)methyl]-5,7-dioxo-6,7-dihydro[1,2]thiazolo[4,3-d]pyrimidin-4(5H)-yl}-N-[(oxolan-2-yl)methyl]acetamide
2-{6-[(3-methylphenyl)methyl]-5,7-dioxo-6,7-dihydro[1,2]thiazolo[4,3-d]pyrimidin-4(5H)-yl}-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | M867-0231 |
| Compound Name: | 2-{6-[(3-methylphenyl)methyl]-5,7-dioxo-6,7-dihydro[1,2]thiazolo[4,3-d]pyrimidin-4(5H)-yl}-N-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 414.48 |
| Molecular Formula: | C20 H22 N4 O4 S |
| Smiles: | Cc1cccc(CN2C(c3c(csn3)N(CC(NCC3CCCO3)=O)C2=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0715 |
| logD: | 2.0715 |
| logSw: | -2.5918 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.484 |
| InChI Key: | SLUNVAWXFZEPQA-OAHLLOKOSA-N |