2-{[(6-fluoro-2H,4H-1,3-benzodioxin-8-yl)methyl]sulfanyl}-3-[(thiophen-2-yl)methyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(6-fluoro-2H,4H-1,3-benzodioxin-8-yl)methyl]sulfanyl}-3-[(thiophen-2-yl)methyl]quinazolin-4(3H)-one
2-{[(6-fluoro-2H,4H-1,3-benzodioxin-8-yl)methyl]sulfanyl}-3-[(thiophen-2-yl)methyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-1416 |
| Compound Name: | 2-{[(6-fluoro-2H,4H-1,3-benzodioxin-8-yl)methyl]sulfanyl}-3-[(thiophen-2-yl)methyl]quinazolin-4(3H)-one |
| Molecular Weight: | 440.51 |
| Molecular Formula: | C22 H17 F N2 O3 S2 |
| Smiles: | C(c1cccs1)N1C(=Nc2ccccc2C1=O)SCc1cc(cc2COCOc12)F |
| Stereo: | ACHIRAL |
| logP: | 4.6186 |
| logD: | 4.6186 |
| logSw: | -4.5737 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.679 |
| InChI Key: | RVNZGUBPMDMLBL-UHFFFAOYSA-N |