N-(2-chloro-4-methylphenyl)-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-methylphenyl)-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-methylphenyl)-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: | L862-0057 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-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: | 447.94 |
| Molecular Formula: | C20 H22 Cl N5 O3 S |
| Smiles: | CCN1C(c2c(nc(N3CCCC3)s2)N(CC(Nc2ccc(C)cc2[Cl])=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2462 |
| logD: | 4.2461 |
| logSw: | -4.3826 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.636 |
| InChI Key: | HUBLMLALXQBGKM-UHFFFAOYSA-N |