1-[(4-chlorophenyl)methyl]-3-({[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-3-({[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(4-chlorophenyl)methyl]-3-({[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0197 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-3-({[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 494.97 |
| Molecular Formula: | C27 H27 Cl N2 O5 |
| Smiles: | COc1cc(CNCc2c3ccccc3n(Cc3ccc(cc3)[Cl])c2C(O)=O)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.5714 |
| logD: | 4.5714 |
| logSw: | -4.6868 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.62 |
| InChI Key: | SKLRYOFDZVXLQQ-UHFFFAOYSA-N |