1-[(4-ethenylphenyl)methyl]-6-methyl-3-({[(oxolan-2-yl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(4-ethenylphenyl)methyl]-6-methyl-3-({[(oxolan-2-yl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(4-ethenylphenyl)methyl]-6-methyl-3-({[(oxolan-2-yl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E847-0375 |
| Compound Name: | 1-[(4-ethenylphenyl)methyl]-6-methyl-3-({[(oxolan-2-yl)methyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C25 H28 N2 O3 |
| Smiles: | Cc1ccc2c(CNCC3CCCO3)c(C(O)=O)n(Cc3ccc(C=C)cc3)c2c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0267 |
| logD: | 4.0267 |
| logSw: | -4.1442 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.297 |
| InChI Key: | YMBCXCLBUIELOK-HXUWFJFHSA-N |