1-(4-methylphenyl)-N-[(9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]ethan-1-imine
Chemical Structure Depiction of
1-(4-methylphenyl)-N-[(9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]ethan-1-imine
1-(4-methylphenyl)-N-[(9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]ethan-1-imine
Compound characteristics
| Compound ID: | 4072-2801 |
| Compound Name: | 1-(4-methylphenyl)-N-[(9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]ethan-1-imine |
| Molecular Weight: | 405.52 |
| Molecular Formula: | C22 H23 N5 O S |
| Smiles: | C\C(c1ccc(C)cc1)=N/OCc1nc2c3c4CCCCCc4sc3N=Cn2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2912 |
| logD: | 5.2894 |
| logSw: | -5.3056 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.097 |
| InChI Key: | MJEFPZQWPLRGQY-UHFFFAOYSA-N |