2-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
Chemical Structure Depiction of
2-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
2-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
Compound characteristics
| Compound ID: | K810-0036 |
| Compound Name: | 2-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine |
| Molecular Weight: | 429.54 |
| Molecular Formula: | C25 H23 N3 O2 S |
| Smiles: | C1CCc2c(C1)c1c(Nc3ccc4c(c3)OCCO4)nc(Cc3ccccc3)nc1s2 |
| Stereo: | ACHIRAL |
| logP: | 5.5368 |
| logD: | 5.5319 |
| logSw: | -6.1036 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.929 |
| InChI Key: | GLJWBIPXUGGLHM-UHFFFAOYSA-N |