N-[1-(2,3-dihydro-1,4-benzodioxin-2-yl)ethyl]-N'-phenylthiourea
Chemical Structure Depiction of
N-[1-(2,3-dihydro-1,4-benzodioxin-2-yl)ethyl]-N'-phenylthiourea
N-[1-(2,3-dihydro-1,4-benzodioxin-2-yl)ethyl]-N'-phenylthiourea
Compound characteristics
| Compound ID: | 3379-0458 |
| Compound Name: | N-[1-(2,3-dihydro-1,4-benzodioxin-2-yl)ethyl]-N'-phenylthiourea |
| Molecular Weight: | 314.4 |
| Molecular Formula: | C17 H18 N2 O2 S |
| Smiles: | CC(C1COc2ccccc2O1)NC(Nc1ccccc1)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9064 |
| logD: | 3.9064 |
| logSw: | -4.1594 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 34.983 |
| InChI Key: | OFWGWRCVTONDAC-UHFFFAOYSA-N |