2-[3-oxo-8-(pyrrolidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-[(thiophen-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-[3-oxo-8-(pyrrolidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-[(thiophen-2-yl)methyl]acetamide
2-[3-oxo-8-(pyrrolidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-[(thiophen-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | M447-0126 |
| Compound Name: | 2-[3-oxo-8-(pyrrolidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-[(thiophen-2-yl)methyl]acetamide |
| Molecular Weight: | 415.49 |
| Molecular Formula: | C17 H17 N7 O2 S2 |
| Smiles: | C1CCN(C1)c1nc2c(C3=NN(CC(NCc4cccs4)=O)C(N3C=N2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.4138 |
| logD: | 2.4123 |
| logSw: | -2.7459 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.392 |
| InChI Key: | CLRUSQIBAWNCRK-UHFFFAOYSA-N |