ethyl 3-{(2-chlorophenyl)[(2-{4-[(3-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-2-oxoethyl)sulfanyl]methyl}-5-methoxy-1H-indole-2-carboxylate
Chemical Structure Depiction of
ethyl 3-{(2-chlorophenyl)[(2-{4-[(3-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-2-oxoethyl)sulfanyl]methyl}-5-methoxy-1H-indole-2-carboxylate
ethyl 3-{(2-chlorophenyl)[(2-{4-[(3-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-2-oxoethyl)sulfanyl]methyl}-5-methoxy-1H-indole-2-carboxylate
Compound characteristics
| Compound ID: | C301-3770 |
| Compound Name: | ethyl 3-{(2-chlorophenyl)[(2-{4-[(3-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-2-oxoethyl)sulfanyl]methyl}-5-methoxy-1H-indole-2-carboxylate |
| Molecular Weight: | 702.7 |
| Molecular Formula: | C38 H37 Cl2 N3 O4 S |
| Smiles: | CCOC(c1c(C(c2ccccc2[Cl])SCC(N2CCN(CC2)C(c2ccccc2)c2cccc(c2)[Cl])=O)c2cc(ccc2[nH]1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 8.3641 |
| logD: | 8.3637 |
| logSw: | -6.4576 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.066 |
| InChI Key: | DKEPFNZPQHIJKE-UHFFFAOYSA-N |