ethyl 3-[(2-chlorophenyl)({2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)methyl]-5-methoxy-1H-indole-2-carboxylate
Chemical Structure Depiction of
ethyl 3-[(2-chlorophenyl)({2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)methyl]-5-methoxy-1H-indole-2-carboxylate
ethyl 3-[(2-chlorophenyl)({2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)methyl]-5-methoxy-1H-indole-2-carboxylate
Compound characteristics
| Compound ID: | C301-3768 |
| Compound Name: | ethyl 3-[(2-chlorophenyl)({2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)methyl]-5-methoxy-1H-indole-2-carboxylate |
| Molecular Weight: | 623.13 |
| Molecular Formula: | C31 H31 Cl N4 O6 S |
| Smiles: | CCOC(c1c(C(c2ccccc2[Cl])SCC(N2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)=O)c2cc(ccc2[nH]1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1876 |
| logD: | 6.1876 |
| logSw: | -6.0868 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.147 |
| InChI Key: | FYTRHZBOZXTUHO-SSEXGKCCSA-N |