propyl N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-[4-(trifluoromethyl)benzoyl]carbamimidate
Chemical Structure Depiction of
propyl N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-[4-(trifluoromethyl)benzoyl]carbamimidate
propyl N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-[4-(trifluoromethyl)benzoyl]carbamimidate
Compound characteristics
| Compound ID: | V015-2206 |
| Compound Name: | propyl N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-[4-(trifluoromethyl)benzoyl]carbamimidate |
| Molecular Weight: | 408.38 |
| Molecular Formula: | C20 H19 F3 N2 O4 |
| Smiles: | CCCOC(/NCc1ccc2c(c1)OCO2)=N/C(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8286 |
| logD: | 3.8162 |
| logSw: | -4.0038 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.494 |
| InChI Key: | ZKNQZZTUWYFNDP-UHFFFAOYSA-N |