1-(3,4-dimethoxyphenyl)-N-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]methanimine
Chemical Structure Depiction of
1-(3,4-dimethoxyphenyl)-N-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]methanimine
1-(3,4-dimethoxyphenyl)-N-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]methanimine
Compound characteristics
| Compound ID: | 3235-0257 |
| Compound Name: | 1-(3,4-dimethoxyphenyl)-N-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]methanimine |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C21 H21 N5 O3 S |
| Smiles: | COc1ccc(/C=N/OCc2nc3c4c5CCCCc5sc4N=Cn3n2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.4761 |
| logD: | 3.4758 |
| logSw: | -4.0502 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.2 |
| InChI Key: | PHMNDAPQFYCRCU-UHFFFAOYSA-N |