3-[(cyclooctylamino)methyl]-1-ethyl-6-methoxy-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-[(cyclooctylamino)methyl]-1-ethyl-6-methoxy-1H-indole-2-carboxylic acid
3-[(cyclooctylamino)methyl]-1-ethyl-6-methoxy-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-1085 |
| Compound Name: | 3-[(cyclooctylamino)methyl]-1-ethyl-6-methoxy-1H-indole-2-carboxylic acid |
| Molecular Weight: | 358.48 |
| Molecular Formula: | C21 H30 N2 O3 |
| Smiles: | CCn1c(C(O)=O)c(CNC2CCCCCCC2)c2ccc(cc12)OC |
| Stereo: | ACHIRAL |
| logP: | 4.4052 |
| logD: | 4.4052 |
| logSw: | -4.3049 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.03 |
| InChI Key: | RHSMDRGYIYASRL-UHFFFAOYSA-N |