2,2,2-trifluoroethyl 2-{[2-(7-fluoro-2-methyl-1H-indol-3-yl)ethyl]carbamoyl}cyclohexane-1-carboxylate--oxalic acid (1/1)
Chemical Structure Depiction of
2,2,2-trifluoroethyl 2-{[2-(7-fluoro-2-methyl-1H-indol-3-yl)ethyl]carbamoyl}cyclohexane-1-carboxylate--oxalic acid (1/1)
2,2,2-trifluoroethyl 2-{[2-(7-fluoro-2-methyl-1H-indol-3-yl)ethyl]carbamoyl}cyclohexane-1-carboxylate--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 8015-8314 |
| Compound Name: | 2,2,2-trifluoroethyl 2-{[2-(7-fluoro-2-methyl-1H-indol-3-yl)ethyl]carbamoyl}cyclohexane-1-carboxylate--oxalic acid (1/1) |
| Molecular Weight: | 518.46 |
| Molecular Formula: | C21 H24 F4 N2 O3 |
| Salt: | HOOCCOOH |
| Smiles: | Cc1c(CCNC(C2CCCCC2C(=O)OCC(F)(F)F)=O)c2cccc(c2[nH]1)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3702 |
| logD: | 4.3702 |
| logSw: | -4.5132 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.511 |
| InChI Key: | WVASHTRQOJJJRO-UHFFFAOYSA-N |