3-[(cycloheptylamino)methyl]-1-[(2,5-dimethylphenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-[(cycloheptylamino)methyl]-1-[(2,5-dimethylphenyl)methyl]-1H-indole-2-carboxylic acid
3-[(cycloheptylamino)methyl]-1-[(2,5-dimethylphenyl)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-1536 |
| Compound Name: | 3-[(cycloheptylamino)methyl]-1-[(2,5-dimethylphenyl)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 404.55 |
| Molecular Formula: | C26 H32 N2 O2 |
| Smiles: | Cc1ccc(C)c(Cn2c(C(O)=O)c(CNC3CCCCCC3)c3ccccc23)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.1646 |
| logD: | 6.1646 |
| logSw: | -5.2847 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.489 |
| InChI Key: | RKIBYWXCDFMFKN-UHFFFAOYSA-N |