N-ethyl-1-[6-(2-{[(4-fluorophenyl)methyl]amino}-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-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl]piperidine-4-carboxamide
N-ethyl-1-[6-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L865-1739 |
| Compound Name: | N-ethyl-1-[6-(2-{[(4-fluorophenyl)methyl]amino}-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(NCc3ccc(cc3)F)=O)C=N2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6489 |
| logD: | 1.6489 |
| logSw: | -2.4886 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.97 |
| InChI Key: | WRKKTWJFOWQKIZ-UHFFFAOYSA-N |