3-[(cyclohexylamino)methyl]-6-methoxy-1-[(4-methoxyphenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-[(cyclohexylamino)methyl]-6-methoxy-1-[(4-methoxyphenyl)methyl]-1H-indole-2-carboxylic acid
3-[(cyclohexylamino)methyl]-6-methoxy-1-[(4-methoxyphenyl)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0758 |
| Compound Name: | 3-[(cyclohexylamino)methyl]-6-methoxy-1-[(4-methoxyphenyl)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 422.52 |
| Molecular Formula: | C25 H30 N2 O4 |
| Smiles: | COc1ccc(Cn2c(C(O)=O)c(CNC3CCCCC3)c3ccc(cc23)OC)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5598 |
| logD: | 4.5598 |
| logSw: | -4.389 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.246 |
| InChI Key: | CESMIHTYGRQPDB-UHFFFAOYSA-N |