N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-{benzyl[(2-fluorophenyl)methyl]carbamothioyl}glycinamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-{benzyl[(2-fluorophenyl)methyl]carbamothioyl}glycinamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-{benzyl[(2-fluorophenyl)methyl]carbamothioyl}glycinamide
Compound characteristics
| Compound ID: | K784-5764 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-{benzyl[(2-fluorophenyl)methyl]carbamothioyl}glycinamide |
| Molecular Weight: | 465.55 |
| Molecular Formula: | C25 H24 F N3 O3 S |
| Smiles: | C(C(NCc1ccc2c(c1)OCO2)=O)NC(N(Cc1ccccc1)Cc1ccccc1F)=S |
| Stereo: | ACHIRAL |
| logP: | 4.771 |
| logD: | 4.771 |
| logSw: | -4.8548 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.337 |
| InChI Key: | UYHBLQDUTODGHL-UHFFFAOYSA-N |