{3-[(2-fluorophenyl)methyl]-1,3-diazinan-1-yl}(4H-thieno[3,2-c][1]benzopyran-2-yl)methanone
Chemical Structure Depiction of
{3-[(2-fluorophenyl)methyl]-1,3-diazinan-1-yl}(4H-thieno[3,2-c][1]benzopyran-2-yl)methanone
{3-[(2-fluorophenyl)methyl]-1,3-diazinan-1-yl}(4H-thieno[3,2-c][1]benzopyran-2-yl)methanone
Compound characteristics
| Compound ID: | C712-1352 |
| Compound Name: | {3-[(2-fluorophenyl)methyl]-1,3-diazinan-1-yl}(4H-thieno[3,2-c][1]benzopyran-2-yl)methanone |
| Molecular Weight: | 408.49 |
| Molecular Formula: | C23 H21 F N2 O2 S |
| Smiles: | C1CN(Cc2ccccc2F)CN(C1)C(c1cc2COc3ccccc3c2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7723 |
| logD: | 4.766 |
| logSw: | -4.7444 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.2838 |
| InChI Key: | DNOFEFSXAMIJNB-UHFFFAOYSA-N |