3-({[(5-bromo-2-methoxyphenyl)methyl]amino}methyl)-1-[(4-ethenylphenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-({[(5-bromo-2-methoxyphenyl)methyl]amino}methyl)-1-[(4-ethenylphenyl)methyl]-1H-indole-2-carboxylic acid
3-({[(5-bromo-2-methoxyphenyl)methyl]amino}methyl)-1-[(4-ethenylphenyl)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E693-0573 |
| Compound Name: | 3-({[(5-bromo-2-methoxyphenyl)methyl]amino}methyl)-1-[(4-ethenylphenyl)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 505.41 |
| Molecular Formula: | C27 H25 Br N2 O3 |
| Smiles: | COc1ccc(cc1CNCc1c2ccccc2n(Cc2ccc(C=C)cc2)c1C(O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.6481 |
| logD: | 5.6481 |
| logSw: | -5.5823 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.273 |
| InChI Key: | MTEGFSMFHQLFND-UHFFFAOYSA-N |