N-cyclopropyl-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-cyclopropyl-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-cyclopropyl-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: | L865-2849 |
| Compound Name: | N-cyclopropyl-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: | 498.63 |
| Molecular Formula: | C23 H26 N6 O3 S2 |
| Smiles: | CSc1cccc(c1)NC(CN1C=Nc2c(C1=O)sc(n2)N1CCC(CC1)C(NC1CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.616 |
| logD: | 2.616 |
| logSw: | -3.0205 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.807 |
| InChI Key: | YWMHZSQPNKGBMV-UHFFFAOYSA-N |