N-methyl-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-methyl-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-methyl-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: | L865-1553 |
| Compound Name: | N-methyl-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: | 472.59 |
| Molecular Formula: | C21 H24 N6 O3 S2 |
| Smiles: | CNC(C1CCN(CC1)c1nc2c(C(N(CC(Nc3cccc(c3)SC)=O)C=N2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.054 |
| logD: | 2.054 |
| logSw: | -2.9058 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.172 |
| InChI Key: | PUIZXAKDCFHWMO-UHFFFAOYSA-N |