1-[(4-methoxyphenyl)methyl]-3-{[(2-phenylpropyl)amino]methyl}-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(4-methoxyphenyl)methyl]-3-{[(2-phenylpropyl)amino]methyl}-1H-indole-2-carboxylic acid
1-[(4-methoxyphenyl)methyl]-3-{[(2-phenylpropyl)amino]methyl}-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0250 |
| Compound Name: | 1-[(4-methoxyphenyl)methyl]-3-{[(2-phenylpropyl)amino]methyl}-1H-indole-2-carboxylic acid |
| Molecular Weight: | 428.53 |
| Molecular Formula: | C27 H28 N2 O3 |
| Smiles: | CC(CNCc1c2ccccc2n(Cc2ccc(cc2)OC)c1C(O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3501 |
| logD: | 5.3501 |
| logSw: | -5.4578 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.186 |
| InChI Key: | KLBSDNMNRJGLEA-IBGZPJMESA-N |