N-[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]-N'-[3-(methylsulfanyl)phenyl]urea
Chemical Structure Depiction of
N-[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]-N'-[3-(methylsulfanyl)phenyl]urea
N-[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]-N'-[3-(methylsulfanyl)phenyl]urea
Compound characteristics
| Compound ID: | F107-1996 |
| Compound Name: | N-[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]-N'-[3-(methylsulfanyl)phenyl]urea |
| Molecular Weight: | 464.54 |
| Molecular Formula: | C25 H24 N2 O5 S |
| Smiles: | CSc1cccc(c1)NC(NC(Cc1ccc2c(c1)OCO2)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.579 |
| logD: | 5.5789 |
| logSw: | -5.5166 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.732 |
| InChI Key: | OKNNNVAQSQWXDE-UHFFFAOYSA-N |