N-(2-chloro-4-fluorophenyl)-2-[6-ethyl-5,7-dioxo-2-(pyrrolidin-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]acetamide
Chemical Structure Depiction of
N-(2-chloro-4-fluorophenyl)-2-[6-ethyl-5,7-dioxo-2-(pyrrolidin-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]acetamide
N-(2-chloro-4-fluorophenyl)-2-[6-ethyl-5,7-dioxo-2-(pyrrolidin-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]acetamide
Compound characteristics
| Compound ID: | L862-0046 |
| Compound Name: | N-(2-chloro-4-fluorophenyl)-2-[6-ethyl-5,7-dioxo-2-(pyrrolidin-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]acetamide |
| Molecular Weight: | 451.91 |
| Molecular Formula: | C19 H19 Cl F N5 O3 S |
| Smiles: | CCN1C(c2c(nc(N3CCCC3)s2)N(CC(Nc2ccc(cc2[Cl])F)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9556 |
| logD: | 3.949 |
| logSw: | -4.1497 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.636 |
| InChI Key: | VCOHSQWEJSXSMW-UHFFFAOYSA-N |