ethyl 5-(acetyloxy)-6-bromo-1-methyl-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(acetyloxy)-6-bromo-1-methyl-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate
ethyl 5-(acetyloxy)-6-bromo-1-methyl-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate
Compound characteristics
| Compound ID: | 2686-0010 |
| Compound Name: | ethyl 5-(acetyloxy)-6-bromo-1-methyl-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate |
| Molecular Weight: | 462.36 |
| Molecular Formula: | C21 H20 Br N O4 S |
| Smiles: | CCOC(c1c2cc(c(cc2n(C)c1CSc1ccccc1)[Br])OC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7058 |
| logD: | 4.7058 |
| logSw: | -4.6053 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 43.351 |
| InChI Key: | PLUCUIPGCPBWEW-UHFFFAOYSA-N |