1-[(4-chlorophenyl)methyl]-3-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-3-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(4-chlorophenyl)methyl]-3-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-2221 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-3-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 478.98 |
| Molecular Formula: | C27 H27 Cl N2 O4 |
| Smiles: | COc1ccc(CCNCc2c3ccccc3n(Cc3ccc(cc3)[Cl])c2C(O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.1349 |
| logD: | 4.1349 |
| logSw: | -4.4698 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.745 |
| InChI Key: | ZQZJEIDXENXANM-UHFFFAOYSA-N |