1-[(2-fluorophenyl)methyl]-3-({[2-(3,4,5-trimethoxyphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2-fluorophenyl)methyl]-3-({[2-(3,4,5-trimethoxyphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(2-fluorophenyl)methyl]-3-({[2-(3,4,5-trimethoxyphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0072 |
| Compound Name: | 1-[(2-fluorophenyl)methyl]-3-({[2-(3,4,5-trimethoxyphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 492.55 |
| Molecular Formula: | C28 H29 F N2 O5 |
| Smiles: | COc1cc(CCNCc2c3ccccc3n(Cc3ccccc3F)c2C(O)=O)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.962 |
| logD: | 3.962 |
| logSw: | -4.2155 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.462 |
| InChI Key: | SXAJEJWWJAQQKD-UHFFFAOYSA-N |