N-ethyl-1-(6-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-ethyl-1-(6-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl)piperidine-4-carboxamide
N-ethyl-1-(6-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L865-1697 |
| Compound Name: | N-ethyl-1-(6-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl)piperidine-4-carboxamide |
| Molecular Weight: | 486.61 |
| Molecular Formula: | C22 H26 N6 O3 S2 |
| Smiles: | CCNC(C1CCN(CC1)c1nc2c(C(N(CC(Nc3cccc(c3)SC)=O)C=N2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.503 |
| logD: | 2.503 |
| logSw: | -2.925 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.648 |
| InChI Key: | HNGRUQBGNAMRRJ-UHFFFAOYSA-N |