1-{[3-chloro-2-fluoro-5-(trifluoromethyl)phenyl]methyl}-4-(4-cyanophenyl)-1H-indol-5-yl diethylcarbamate
Chemical Structure Depiction of
1-{[3-chloro-2-fluoro-5-(trifluoromethyl)phenyl]methyl}-4-(4-cyanophenyl)-1H-indol-5-yl diethylcarbamate
1-{[3-chloro-2-fluoro-5-(trifluoromethyl)phenyl]methyl}-4-(4-cyanophenyl)-1H-indol-5-yl diethylcarbamate
Compound characteristics
| Compound ID: | V021-0370 |
| Compound Name: | 1-{[3-chloro-2-fluoro-5-(trifluoromethyl)phenyl]methyl}-4-(4-cyanophenyl)-1H-indol-5-yl diethylcarbamate |
| Molecular Weight: | 543.95 |
| Molecular Formula: | C28 H22 Cl F4 N3 O2 |
| Smiles: | CCN(CC)C(=O)Oc1ccc2c(ccn2Cc2cc(cc(c2F)[Cl])C(F)(F)F)c1c1ccc(C#N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 7.4745 |
| logD: | 7.4745 |
| logSw: | -6.7134 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.829 |
| InChI Key: | NMSJDIFXWRIQLP-UHFFFAOYSA-N |