ethyl 3-{2-[2-(4-ethylpiperazin-1-yl)-7-oxo[1,3]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 3-{2-[2-(4-ethylpiperazin-1-yl)-7-oxo[1,3]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamido}benzoate
ethyl 3-{2-[2-(4-ethylpiperazin-1-yl)-7-oxo[1,3]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | F801-0321 |
| Compound Name: | ethyl 3-{2-[2-(4-ethylpiperazin-1-yl)-7-oxo[1,3]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamido}benzoate |
| Molecular Weight: | 470.55 |
| Molecular Formula: | C22 H26 N6 O4 S |
| Smiles: | CCN1CCN(CC1)c1nc2c(C(N(CC(Nc3cccc(c3)C(=O)OCC)=O)C=N2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.983 |
| logD: | 2.13 |
| logSw: | -3.2258 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.627 |
| InChI Key: | DCUMMULBZYBUML-UHFFFAOYSA-N |