1-[(4-chlorophenyl)methyl]-3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(4-chlorophenyl)methyl]-3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0207 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 464.95 |
| Molecular Formula: | C26 H25 Cl N2 O4 |
| Smiles: | COc1ccc(c(CNCc2c3ccccc3n(Cc3ccc(cc3)[Cl])c2C(O)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.9552 |
| logD: | 4.9552 |
| logSw: | -4.8409 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.817 |
| InChI Key: | YSRNPMJZKUIRNI-UHFFFAOYSA-N |