ethyl 2-[(benzenesulfonyl)methyl]-6-bromo-5-hydroxy-1-methyl-1H-indole-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(benzenesulfonyl)methyl]-6-bromo-5-hydroxy-1-methyl-1H-indole-3-carboxylate
ethyl 2-[(benzenesulfonyl)methyl]-6-bromo-5-hydroxy-1-methyl-1H-indole-3-carboxylate
Compound characteristics
| Compound ID: | 8004-2667 |
| Compound Name: | ethyl 2-[(benzenesulfonyl)methyl]-6-bromo-5-hydroxy-1-methyl-1H-indole-3-carboxylate |
| Molecular Weight: | 452.32 |
| Molecular Formula: | C19 H18 Br N O5 S |
| Smiles: | CCOC(c1c2cc(c(cc2n(C)c1CS(c1ccccc1)(=O)=O)[Br])O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3373 |
| logD: | 3.3086 |
| logSw: | -3.512 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.097 |
| InChI Key: | NNMHPRLYFSJAGD-UHFFFAOYSA-N |