1-[(2-chloro-4-fluorophenyl)methyl]-3-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-6-methoxy-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-3-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-6-methoxy-1H-indole-2-carboxylic acid
1-[(2-chloro-4-fluorophenyl)methyl]-3-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-6-methoxy-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E847-0115 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-3-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-6-methoxy-1H-indole-2-carboxylic acid |
| Molecular Weight: | 505.98 |
| Molecular Formula: | C28 H25 Cl F N3 O3 |
| Smiles: | COc1ccc2c(CNCCc3c[nH]c4ccccc34)c(C(O)=O)n(Cc3ccc(cc3[Cl])F)c2c1 |
| Stereo: | ACHIRAL |
| logP: | 5.3292 |
| logD: | 5.3292 |
| logSw: | -5.6295 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 57.898 |
| InChI Key: | UYWHYHOXRGEEHG-UHFFFAOYSA-N |