{1-[2-chloro-5-(trifluoromethyl)phenyl]-2,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indol-3-yl}acetic acid
Chemical Structure Depiction of
{1-[2-chloro-5-(trifluoromethyl)phenyl]-2,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indol-3-yl}acetic acid
{1-[2-chloro-5-(trifluoromethyl)phenyl]-2,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indol-3-yl}acetic acid
Compound characteristics
| Compound ID: | 8012-0481 |
| Compound Name: | {1-[2-chloro-5-(trifluoromethyl)phenyl]-2,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indol-3-yl}acetic acid |
| Molecular Weight: | 413.82 |
| Molecular Formula: | C20 H19 Cl F3 N O3 |
| Smiles: | Cc1c(CC(O)=O)c2C(CC(C)(C)Cc2n1c1cc(ccc1[Cl])C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2944 |
| logD: | 0.7541 |
| logSw: | -4.5537 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.915 |
| InChI Key: | AEWDQYMXLGFAGL-UHFFFAOYSA-N |