N-[(4-methylphenyl)methyl]-2-(3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-(3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
N-[(4-methylphenyl)methyl]-2-(3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | F815-0417 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-(3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide |
| Molecular Weight: | 407.49 |
| Molecular Formula: | C21 H21 N5 O2 S |
| Smiles: | Cc1ccc(CNC(CN2C(N3C=Nc4c(C3=N2)c2CCCCc2s4)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2198 |
| logD: | 3.2198 |
| logSw: | -3.5625 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.982 |
| InChI Key: | MUDFDDUNMVBFON-UHFFFAOYSA-N |