N-ethyl-1-{6-[2-(5-fluoro-2-methylanilino)-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-(5-fluoro-2-methylanilino)-2-oxoethyl]-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl}piperidine-4-carboxamide
N-ethyl-1-{6-[2-(5-fluoro-2-methylanilino)-2-oxoethyl]-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L865-1706 |
| Compound Name: | N-ethyl-1-{6-[2-(5-fluoro-2-methylanilino)-2-oxoethyl]-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl}piperidine-4-carboxamide |
| Molecular Weight: | 472.54 |
| Molecular Formula: | C22 H25 F N6 O3 S |
| Smiles: | CCNC(C1CCN(CC1)c1nc2c(C(N(CC(Nc3cc(ccc3C)F)=O)C=N2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9644 |
| logD: | 1.9642 |
| logSw: | -2.7129 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.95 |
| InChI Key: | AOTHKKGKTMFOGF-UHFFFAOYSA-N |