2-[5,7-dioxo-6-propyl-2-(pyrrolidin-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]-N-(4-ethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[5,7-dioxo-6-propyl-2-(pyrrolidin-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]-N-(4-ethoxyphenyl)acetamide
2-[5,7-dioxo-6-propyl-2-(pyrrolidin-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]-N-(4-ethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | L862-0159 |
| Compound Name: | 2-[5,7-dioxo-6-propyl-2-(pyrrolidin-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]-N-(4-ethoxyphenyl)acetamide |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C22 H27 N5 O4 S |
| Smiles: | CCCN1C(c2c(nc(N3CCCC3)s2)N(CC(Nc2ccc(cc2)OCC)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4067 |
| logD: | 4.4067 |
| logSw: | -3.928 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.712 |
| InChI Key: | QVTWMGNBEQQSIP-UHFFFAOYSA-N |