1-benzyl-6-methoxy-3-{[(3-phenylpropyl)amino]methyl}-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-benzyl-6-methoxy-3-{[(3-phenylpropyl)amino]methyl}-1H-indole-2-carboxylic acid
1-benzyl-6-methoxy-3-{[(3-phenylpropyl)amino]methyl}-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-1021 |
| Compound Name: | 1-benzyl-6-methoxy-3-{[(3-phenylpropyl)amino]methyl}-1H-indole-2-carboxylic acid |
| Molecular Weight: | 428.53 |
| Molecular Formula: | C27 H28 N2 O3 |
| Smiles: | COc1ccc2c(CNCCCc3ccccc3)c(C(O)=O)n(Cc3ccccc3)c2c1 |
| Stereo: | ACHIRAL |
| logP: | 5.0351 |
| logD: | 5.0351 |
| logSw: | -4.6978 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.028 |
| InChI Key: | SBUJWOUPIVRJAJ-UHFFFAOYSA-N |