3-{[(butan-2-yl)amino]methyl}-1-[(4-methoxyphenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-{[(butan-2-yl)amino]methyl}-1-[(4-methoxyphenyl)methyl]-1H-indole-2-carboxylic acid
3-{[(butan-2-yl)amino]methyl}-1-[(4-methoxyphenyl)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0223 |
| Compound Name: | 3-{[(butan-2-yl)amino]methyl}-1-[(4-methoxyphenyl)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 366.46 |
| Molecular Formula: | C22 H26 N2 O3 |
| Smiles: | CCC(C)NCc1c2ccccc2n(Cc2ccc(cc2)OC)c1C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7957 |
| logD: | 3.7957 |
| logSw: | -3.9493 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.69 |
| InChI Key: | AWNFPTDFHVBFRC-HNNXBMFYSA-N |