3-benzylidene-N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-2-(morpholin-4-yl)cyclohex-1-ene-1-carboxamide
Chemical Structure Depiction of
3-benzylidene-N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-2-(morpholin-4-yl)cyclohex-1-ene-1-carboxamide
3-benzylidene-N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-2-(morpholin-4-yl)cyclohex-1-ene-1-carboxamide
Compound characteristics
| Compound ID: | 3334-5270 |
| Compound Name: | 3-benzylidene-N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-2-(morpholin-4-yl)cyclohex-1-ene-1-carboxamide |
| Molecular Weight: | 520.94 |
| Molecular Formula: | C26 H24 Cl F3 N2 O4 |
| Smiles: | C1C/C(=C\c2ccccc2)C(=C(C1)C(NC1(C(F)(F)F)Oc2ccc(cc2O1)[Cl])=O)N1CCOCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1224 |
| logD: | 2.9821 |
| logSw: | -6.3099 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.621 |
| InChI Key: | XBSHWULIMHYDME-SANMLTNESA-N |