1-[(4-ethenylphenyl)methyl]-3-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(4-ethenylphenyl)methyl]-3-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(4-ethenylphenyl)methyl]-3-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-0544 |
| Compound Name: | 1-[(4-ethenylphenyl)methyl]-3-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C29 H27 N3 O2 |
| Smiles: | C=Cc1ccc(Cn2c(C(O)=O)c(CNCCc3c[nH]c4ccccc34)c3ccccc23)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9687 |
| logD: | 4.9687 |
| logSw: | -4.6375 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 50.355 |
| InChI Key: | QWHKOMHXMNZTCE-UHFFFAOYSA-N |