3-[(cycloheptylamino)methyl]-1-[(4-methoxyphenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-[(cycloheptylamino)methyl]-1-[(4-methoxyphenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid
3-[(cycloheptylamino)methyl]-1-[(4-methoxyphenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E847-0307 |
| Compound Name: | 3-[(cycloheptylamino)methyl]-1-[(4-methoxyphenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid |
| Molecular Weight: | 420.55 |
| Molecular Formula: | C26 H32 N2 O3 |
| Smiles: | Cc1ccc2c(CNC3CCCCCC3)c(C(O)=O)n(Cc3ccc(cc3)OC)c2c1 |
| Stereo: | ACHIRAL |
| logP: | 5.4728 |
| logD: | 5.4728 |
| logSw: | -5.292 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.033 |
| InChI Key: | LFEBZAIXBGNQFK-UHFFFAOYSA-N |