N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-(4-ethylpiperazin-1-yl)-7-oxo[1,3]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-(4-ethylpiperazin-1-yl)-7-oxo[1,3]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-(4-ethylpiperazin-1-yl)-7-oxo[1,3]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamide
Compound characteristics
| Compound ID: | F801-0369 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-(4-ethylpiperazin-1-yl)-7-oxo[1,3]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamide |
| Molecular Weight: | 456.52 |
| Molecular Formula: | C21 H24 N6 O4 S |
| Smiles: | CCN1CCN(CC1)c1nc2c(C(N(CC(NCc3ccc4c(c3)OCO4)=O)C=N2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.6918 |
| logD: | 0.8388 |
| logSw: | -2.6845 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.311 |
| InChI Key: | ABGQOLZXTZVXBW-UHFFFAOYSA-N |