2-methyl-1-(4-nitrophenyl)-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
Chemical Structure Depiction of
2-methyl-1-(4-nitrophenyl)-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
2-methyl-1-(4-nitrophenyl)-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
Compound characteristics
| Compound ID: | 8012-0464 |
| Compound Name: | 2-methyl-1-(4-nitrophenyl)-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one |
| Molecular Weight: | 401.67 |
| Molecular Formula: | C17 H15 Cl3 N2 O3 |
| Smiles: | Cc1c(CC([Cl])([Cl])[Cl])c2C(CCCc2n1c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9347 |
| logD: | 4.9347 |
| logSw: | -5.1358 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.214 |
| InChI Key: | FNNNEWCYVTXSAL-UHFFFAOYSA-N |