ethyl 1-{[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]carbamoyl}piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]carbamoyl}piperidine-3-carboxylate
ethyl 1-{[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]carbamoyl}piperidine-3-carboxylate
Compound characteristics
| Compound ID: | C097-0446 |
| Compound Name: | ethyl 1-{[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]carbamoyl}piperidine-3-carboxylate |
| Molecular Weight: | 457.23 |
| Molecular Formula: | C17 H17 Cl2 F3 N2 O5 |
| Smiles: | CCOC(C1CCCN(C1)C(NC1(C(F)(F)F)Oc2cc(c(cc2O1)[Cl])[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3132 |
| logD: | 3.7728 |
| logSw: | -4.6963 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.486 |
| InChI Key: | QGLOVUXQZSYGIM-VIFPVBQESA-N |